ethyl (5E)-3-methyl-4-oxidanylidene-5-(pyridin-3-ylmethylidene)-6,7-dihydro-1H-indole-2-carboxylate

Systemtic Name: ethyl (5E)-3-methyl-4-oxidanylidene-5-(pyridin-3-ylmethylidene)-6,7-dihydro-1H-indole-2-carboxylate Openeye Name: ethyl (5E)-3-methyl-4-oxo-5-(3-pyridylmethylene)-6,7-dihydro-1H-indole-2-carboxylate CAS Name: (5E)-3-methyl-4-oxo-5-(3-pyridinylmethylidene)-6,7-dihydro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-3-methyl-4-oxo-5-(pyridin-3-ylmethylidene)-6,7-dihydro-1H-indole-2-carboxylate Traditional Name: (5E)-4-keto-3-methyl-5-(3-pyridylmethylene)-6,7-dihydro-1H-indole-2-carboxylic acid ethyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)CCC(=CC3=CN=CC=C3)C2=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)CC/C(=C\C3=CN=CC=C3)/C2=O)C

InChI

InChI=1S/C18H18N2O3/c1-3-23-18(22)16-11(2)15-14(20-16)7-6-13(17(15)21)9-12-5-4-8-19-10-12/h4-5,8-10,20H,3,6-7H2,1-2H3/b13-9+