7-[(4-bromanyl-3-methyl-phenyl)amino]-6-[(4-methoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(4-bromanyl-3-methyl-phenyl)amino]-6-[(4-methoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 7-(4-bromo-3-methyl-anilino)-6-[(4-methoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(4-bromo-3-methylanilino)-6-[(4-methoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 7-(4-bromo-3-methylanilino)-6-[(4-methoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 7-(4-bromo-3-methyl-anilino)-6-p-anisyl-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C22H20BrN3O2 MolecularWeight: 438.3171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=C(C=C4)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C22H20BrN3O2/c1-14-12-16(7-10-19(14)23)25-21-20-18(4-3-11-24-20)22(27)26(21)13-15-5-8-17(28-2)9-6-15/h3-12,21,25H,13H2,1-2H3