ethyl 6-chloranyl-3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-phenyl-indole-1-carboxylate

Systemtic Name: ethyl 6-chloranyl-3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-phenyl-indole-1-carboxylate Openeye Name: ethyl 6-chloro-3-[(E)-3-methoxy-3-oxo-prop-1-enyl]-2-phenyl-indole-1-carboxylate CAS Name: 6-chloro-3-[(E)-3-methoxy-3-oxoprop-1-enyl]-2-phenyl-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-3-[(E)-3-methoxy-3-oxoprop-1-enyl]-2-phenylindole-1-carboxylate Traditional Name: 6-chloro-3-[(E)-3-keto-3-methoxy-prop-1-enyl]-2-phenyl-indole-1-carboxylic acid ethyl ester Formula: C21H18ClNO4 MolecularWeight: 383.82492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C3=CC=CC=C3)C=CC(=O)OC

Isomeric SMILES

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C3=CC=CC=C3)/C=C/C(=O)OC

InChI

InChI=1S/C21H18ClNO4/c1-3-27-21(25)23-18-13-15(22)9-10-16(18)17(11-12-19(24)26-2)20(23)14-7-5-4-6-8-14/h4-13H,3H2,1-2H3/b12-11+