7-[(3,4-dimethoxyphenyl)amino]-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(3,4-dimethoxyphenyl)amino]-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 6-benzyl-7-(3,4-dimethoxyanilino)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(3,4-dimethoxyanilino)-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 6-benzyl-7-(3,4-dimethoxyanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 6-benzyl-7-(3,4-dimethoxyanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=CC=C4)OC

InChI

InChI=1S/C22H21N3O3/c1-27-18-11-10-16(13-19(18)28-2)24-21-20-17(9-6-12-23-20)22(26)25(21)14-15-7-4-3-5-8-15/h3-13,21,24H,14H2,1-2H3