propyl 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate

Systemtic Name: propyl 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate Openeye Name: propyl 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-[1-(2-cyanoethyl)-3-indolyl]-1-oxoprop-2-enyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]acryloyl]amino]benzoic acid propyl ester Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C24H23N3O3/c1-2-16-30-24(29)18-8-11-20(12-9-18)26-23(28)13-10-19-17-27(15-5-14-25)22-7-4-3-6-21(19)22/h3-4,6-13,17H,2,5,15-16H2,1H3,(H,26,28)/b13-10+