methyl (E)-3-[4-[(Z)-2-cyano-2-(1H-indol-3-yl)ethenyl]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[(Z)-2-cyano-2-(1H-indol-3-yl)ethenyl]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-[(Z)-2-cyano-2-(1H-indol-3-yl)vinyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(Z)-2-cyano-2-(1H-indol-3-yl)ethenyl]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[(Z)-2-cyano-2-(1H-indol-3-yl)ethenyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(Z)-2-cyano-2-(1H-indol-3-yl)vinyl]phenyl]acrylic acid methyl ester Formula: C21H16N2O2 MolecularWeight: 328.36394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)C=C(C#N)C2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)/C=C(\C#N)/C2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H16N2O2/c1-25-21(24)11-10-15-6-8-16(9-7-15)12-17(13-22)19-14-23-20-5-3-2-4-18(19)20/h2-12,14,23H,1H3/b11-10+,17-12+