[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 1-cyclopropyl-5-methoxy-2-methyl-indole-3-carboxylate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 1-cyclopropyl-5-methoxy-2-methyl-indole-3-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 1-cyclopropyl-5-methoxy-2-methyl-indole-3-carboxylate CAS Name: 1-cyclopropyl-5-methoxy-2-methyl-3-indolecarboxylic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 1-cyclopropyl-5-methoxy-2-methylindole-3-carboxylate Traditional Name: 1-cyclopropyl-5-methoxy-2-methyl-indole-3-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3CC3)C=CC(=C2)OC)C(=O)OCC(=O)C(=C(C)N)C#N

Isomeric SMILES

CC1=C(C2=C(N1C3CC3)C=CC(=C2)OC)C(=O)OCC(=O)/C(=C(\C)/N)/C#N

InChI

InChI=1S/C20H21N3O4/c1-11(22)16(9-21)18(24)10-27-20(25)19-12(2)23(13-4-5-13)17-7-6-14(26-3)8-15(17)19/h6-8,13H,4-5,10,22H2,1-3H3/b16-11+