3-methoxycarbonyl-2,4-dimethyl-7-oxidanylidene-1-(phenylmethyl)pyrrolo[3,2-b]pyridine-6-carboxylic acid

Systemtic Name: 3-methoxycarbonyl-2,4-dimethyl-7-oxidanylidene-1-(phenylmethyl)pyrrolo[3,2-b]pyridine-6-carboxylic acid Openeye Name: 1-benzyl-3-methoxycarbonyl-2,4-dimethyl-7-oxo-pyrrolo[3,2-b]pyridine-6-carboxylic acid CAS Name: 3-methoxycarbonyl-2,4-dimethyl-7-oxo-1-(phenylmethyl)-6-pyrrolo[3,2-b]pyridinecarboxylic acid IUPAC Name: 1-benzyl-3-methoxycarbonyl-2,4-dimethyl-7-oxopyrrolo[3,2-b]pyridine-6-carboxylic acid Traditional Name: 1-benzyl-3-carbomethoxy-7-keto-2,4-dimethyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C(=O)C(=CN2C)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C(=O)C(=CN2C)C(=O)O)C(=O)OC

InChI

InChI=1S/C19H18N2O5/c1-11-14(19(25)26-3)15-16(17(22)13(18(23)24)10-20(15)2)21(11)9-12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3,(H,23,24)