methyl 2,3-dimethyl-4-oxidanylidene-1-(phenylmethyl)-7H-pyrrolo[2,3-b]pyridine-5-carboxylate

Systemtic Name: methyl 2,3-dimethyl-4-oxidanylidene-1-(phenylmethyl)-7H-pyrrolo[2,3-b]pyridine-5-carboxylate Openeye Name: methyl 1-benzyl-2,3-dimethyl-4-oxo-7H-pyrrolo[2,3-b]pyridine-5-carboxylate CAS Name: 2,3-dimethyl-4-oxo-1-(phenylmethyl)-7H-pyrrolo[2,3-b]pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-2,3-dimethyl-4-oxo-7H-pyrrolo[2,3-b]pyridine-5-carboxylate Traditional Name: 1-benzyl-4-keto-2,3-dimethyl-7H-pyrrolo[2,3-b]pyridine-5-carboxylic acid methyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=O)C(=CN2)C(=O)OC)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C2=C1C(=O)C(=CN2)C(=O)OC)CC3=CC=CC=C3)C

InChI

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