methyl 1-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-[(E)-3-ethoxy-3-oxoprop-1-enyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-ethoxy-3-oxoprop-1-enyl]-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-[(E)-3-ethoxy-3-keto-prop-1-enyl]-9H-$b-carboline-3-carboxylic acid methyl ester Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C2C(=CC(=N1)C(=O)OC)C3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)/C=C/C1=C2C(=CC(=N1)C(=O)OC)C3=CC=CC=C3N2

InChI

InChI=1S/C18H16N2O4/c1-3-24-16(21)9-8-14-17-12(10-15(19-14)18(22)23-2)11-6-4-5-7-13(11)20-17/h4-10,20H,3H2,1-2H3/b9-8+