ethyl 3-[2-(4-oxidanylidene-5H-pyrrolo[3,2-c]pyridin-1-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(4-oxidanylidene-5H-pyrrolo[3,2-c]pyridin-1-yl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(4-oxo-5H-pyrrolo[3,2-c]pyridin-1-yl)acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-(4-oxo-5H-pyrrolo[3,2-c]pyridin-1-yl)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-oxo-5H-pyrrolo[3,2-c]pyridin-1-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-keto-5H-pyrrolo[3,2-c]pyridin-1-yl)acetyl]amino]benzoic acid ethyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C=CC3=C2C=CNC3=O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C=CC3=C2C=CNC3=O

InChI

InChI=1S/C18H17N3O4/c1-2-25-18(24)12-4-3-5-13(10-12)20-16(22)11-21-9-7-14-15(21)6-8-19-17(14)23/h3-10H,2,11H2,1H3,(H,19,23)(H,20,22)