(E)-2-cyano-N-(4-methoxyphenyl)-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-[1-[2-oxo-2-(1-piperidyl)ethyl]indol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-[1-[2-oxo-2-(1-piperidinyl)ethyl]-3-indolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(2-keto-2-piperidino-ethyl)indol-3-yl]-N-(4-methoxyphenyl)acrylamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4)/C#N

InChI

InChI=1S/C26H26N4O3/c1-33-22-11-9-21(10-12-22)28-26(32)19(16-27)15-20-17-30(24-8-4-3-7-23(20)24)18-25(31)29-13-5-2-6-14-29/h3-4,7-12,15,17H,2,5-6,13-14,18H2,1H3,(H,28,32)/b19-15+