Vitas-M small molecule compound

(2E)-N-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)prop-2-enamide

Catalog ID
STK439136
SMILES O=C(Nc1ccc2c(c1)OCO2)/C=C/c1cccc(c1)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H12ClNO3 MW 301.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClNO3/c17-12-3-1-2-11(8-12)4-7-16(19)18-13-5-6-14-15(9-13)21-10-20-14/h1-9H,10H2,(H,18,19)/b7-4+
InChIKey
OXBJRJMKBYKMDN-QPJJXVBHSA-N
Synonyms
133231-92-2
(2E)N(13benzodioxol5yl)3(3chlorophenyl)prop2enamide
(2E)N(2HBENZO(34D)13DIOXOLAN5YL)3(3CHLOROPHENYL)PROP2ENAMIDE
(E)N(13BENZODIOXOL5YL)3(3CHLOROPHENYL)PROP2ENAMIDE
133231922
C1OC2=C(O1)C=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)Cl
InChI=1SC16H12ClNO3c171231211(812)4716(19)1813561415(913)21102014h19H10H2(H1819)b74+
MFCD03386760
N(13BENZODIOXOL5YL)3(3CHLOROPHENYL)ACRYLAMIDE
O=C(Nc1ccc2c(c1)OCO2)C=Cc1cccc(c1)Cl
ZINC000000376403
ZINC00376403
ZINC376403

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Available files

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