(phenylmethyl) 3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]indole-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]indole-1-carboxylate Openeye Name: benzyl 3-[(E)-3-ethoxy-3-oxo-prop-1-enyl]indole-1-carboxylate CAS Name: 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-1-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]indole-1-carboxylate Traditional Name: 3-[(E)-3-ethoxy-3-keto-prop-1-enyl]indole-1-carboxylic acid benzyl ester Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CN(C2=CC=CC=C21)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C1=CN(C2=CC=CC=C21)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4/c1-2-25-20(23)13-12-17-14-22(19-11-7-6-10-18(17)19)21(24)26-15-16-8-4-3-5-9-16/h3-14H,2,15H2,1H3/b13-12+