ethyl 2-[[(Z)-2-cyano-3-[1-(phenylmethyl)indol-3-yl]prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 2-[[(Z)-2-cyano-3-[1-(phenylmethyl)indol-3-yl]prop-2-enoyl]amino]benzoate Openeye Name: ethyl 2-[[(Z)-3-(1-benzylindol-3-yl)-2-cyano-prop-2-enoyl]amino]benzoate CAS Name: 2-[[(Z)-2-cyano-1-oxo-3-[1-(phenylmethyl)-3-indolyl]prop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(Z)-3-(1-benzylindol-3-yl)-2-cyanoprop-2-enoyl]amino]benzoate Traditional Name: 2-[[(Z)-3-(1-benzylindol-3-yl)-2-cyano-acryloyl]amino]benzoic acid ethyl ester Formula: C28H23N3O3 MolecularWeight: 449.50052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)/C#N

InChI

InChI=1S/C28H23N3O3/c1-2-34-28(33)24-13-6-8-14-25(24)30-27(32)21(17-29)16-22-19-31(18-20-10-4-3-5-11-20)26-15-9-7-12-23(22)26/h3-16,19H,2,18H2,1H3,(H,30,32)/b21-16-