methyl 4-[(E)-(2-oxidanylidene-1H-pyrrolo[2,3-b]pyridin-3-ylidene)methyl]benzoate

Systemtic Name: methyl 4-[(E)-(2-oxidanylidene-1H-pyrrolo[2,3-b]pyridin-3-ylidene)methyl]benzoate Openeye Name: methyl 4-[(E)-(2-oxo-1H-pyrrolo[2,3-b]pyridin-3-ylidene)methyl]benzoate CAS Name: 4-[(E)-(2-oxo-1H-pyrrolo[2,3-b]pyridin-3-ylidene)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-(2-oxo-1H-pyrrolo[2,3-b]pyridin-3-ylidene)methyl]benzoate Traditional Name: 4-[(E)-(2-keto-1H-pyrrolo[2,3-b]pyridin-3-ylidene)methyl]benzoic acid methyl ester Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C3=C(NC2=O)N=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/2\C3=C(NC2=O)N=CC=C3

InChI

InChI=1S/C16H12N2O3/c1-21-16(20)11-6-4-10(5-7-11)9-13-12-3-2-8-17-14(12)18-15(13)19/h2-9H,1H3,(H,17,18,19)/b13-9+