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

Systemtic Name: 7-[(3-chloranyl-4-methoxy-phenyl)amino]-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 6-benzyl-7-(3-chloro-4-methoxy-anilino)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(3-chloro-4-methoxyanilino)-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 6-benzyl-7-(3-chloro-4-methoxyanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 6-benzyl-7-(3-chloro-4-methoxy-anilino)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C21H18ClN3O2 MolecularWeight: 379.83952

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O2/c1-27-18-10-9-15(12-17(18)22)24-20-19-16(8-5-11-23-19)21(26)25(20)13-14-6-3-2-4-7-14/h2-12,20,24H,13H2,1H3