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Substance Name: N-(4-Hydroxyphenethyl)cotinine carboxamide
RN: 100333-39-9
InChIKey: AYWZJRYYVZHOQI-FUHWJXTLSA-N

Molecular Weight

  • 339.393
 
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Names and Synonyms

Name of Substance

  • N-(4-Hydroxyphenethyl)cotinine carboxamide

Synonym

  • 4-NCC

Systematic Name

  • 3-Pyrrolidinecarboxamide, N-(2-(4-hydroxyphenyl)ethyl)-1-methyl-5-oxo-2-(3-pyridinyl)-, (2S-trans)-

Registry Numbers

CAS Registry Number

  • 100333-39-9

System Generated Number

  • 0100333399

Structure Descriptors

InChI

1S/C19H21N3O3/c1-22-17(24)11-16(18(22)14-3-2-9-20-12-14)19(25)21-10-8-13-4-6-15(23)7-5-13/h2-7,9,12,16,18,23H,8,10-11H2,1H3,(H,21,25)/t16-,18+/m0/s1

InChIKey

AYWZJRYYVZHOQI-FUHWJXTLSA-N

Smiles

C1C(=O)N(C)[C@@H](c2cnccc2)[C@H]1C(NCCc1ccc(cc1)O)=O