ethyl 3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylate Openeye Name: ethyl 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylate CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylate Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid ethyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)CCCC2)C=CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)CCCC2)/C=C/C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3/c1-2-25-20(24)19-16(15-10-6-7-11-17(15)22-19)12-13-18(23)21-14-8-4-3-5-9-14/h3-5,8-9,12-13,22H,2,6-7,10-11H2,1H3,(H,21,23)/b13-12+