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Substance Name: Bmy 20064
RN: 100305-59-7
InChIKey: QADWEQVSNYLMRN-UHFFFAOYSA-N

Molecular Formula

  • C30-H36-N4-O7

Molecular Weight

  • 564.635
 
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Names and Synonyms

Name of Substance

  • Bmy 20064

Synonym

  • Bmy-20064

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-(4-(2-methoxyphenyl)-1-piperazinyl)propyl methyl ester

Registry Numbers

CAS Registry Number

  • 100305-59-7

System Generated Number

  • 0100305597

Structure Descriptors

InChI

1S/C30H36N4O7/c1-20-26(29(35)40-4)28(22-9-7-10-23(19-22)34(37)38)27(21(2)31-20)30(36)41-18-8-13-32-14-16-33(17-15-32)24-11-5-6-12-25(24)39-3/h5-7,9-12,19,21,26H,8,13-18H2,1-4H3

InChIKey

QADWEQVSNYLMRN-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)OC)N1CCN(CC1)CCCOC(=O)C=1[C@@H](N=C([C@@H](C1c1cc(ccc1)[N+]([O-])=O)C(OC)=O)C)C