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Substance Name: 1H-Indole-5-carboxylic acid, 2-(3-cyano-4-oxo-4-(3-phenylpropoxy)-2-buten-1-ylidene)-2,3-dihydro-1,3,3-trimethyl-, methyl ester
RN: 7064-71-3
InChIKey: PTQRSTLQMHJFDC-VIAAJXJMSA-N

Molecular Formula

  • C27-H28-N2-O4

Molecular Weight

  • 444.528
 
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Names and Synonyms

Synonyms

  • 2-(3-Cyano-3-((3-phenylpropoxy)carbonyl)-2-propenylidene)-1,3,3-trimethyl-2,3-dihydro-1H-indole-5-carboxylic acid, methyl ester
  • EINECS 230-353-8

Systematic Names

  • 1H-Indole-5-carboxylic acid, 2-(3-cyano-4-oxo-4-(3-phenylpropoxy)-2-buten-1-ylidene)-2,3-dihydro-1,3,3-trimethyl-, methyl ester
  • 1H-Indole-5-carboxylic acid, 2-(3-cyano-4-oxo-4-(3-phenylpropoxy)-2-butenylidene)-2,3-dihydro-1,3,3-trimethyl-, methyl ester
  • 5-Methyl 3-phenylpropyl 5-carboxylato-alpha-cyano-1,3,3-trimethylindoline- 2,gamma-crotonate

Registry Numbers

CAS Registry Number

  • 7064-71-3

System Generated Number

  • 0007064713

Structure Descriptors

InChI

1S/C27H28N2O4/c1-27(2)22-17-20(25(30)32-4)12-14-23(22)29(3)24(27)15-13-21(18-28)26(31)33-16-8-11-19-9-6-5-7-10-19/h5-7,9-10,12-15,17H,8,11,16H2,1-4H3/b21-13+,24-15+

InChIKey

PTQRSTLQMHJFDC-VIAAJXJMSA-N

Smiles

O=C(OCCCc1ccccc1)\C(C#N)=C\C=C1\N(c2c(cc(cc2)C(=O)OC)C1(C)C)C