6-[[4-methoxy-3-(4-methylpiperidin-1-yl)sulfonyl-phenyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 6-[[4-methoxy-3-(4-methylpiperidin-1-yl)sulfonyl-phenyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 6-[[4-methoxy-3-[(4-methyl-1-piperidyl)sulfonyl]phenyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 6-[[4-methoxy-3-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 6-[[4-methoxy-3-(4-methylpiperidin-1-yl)sulfonylphenyl]methyl]pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 6-[4-methoxy-3-(4-methylpiperidino)sulfonyl-benzyl]pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)CN3C(=O)C4=C(C3=O)N=CC=C4)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)CN3C(=O)C4=C(C3=O)N=CC=C4)OC

InChI

InChI=1S/C21H23N3O5S/c1-14-7-10-23(11-8-14)30(27,28)18-12-15(5-6-17(18)29-2)13-24-20(25)16-4-3-9-22-19(16)21(24)26/h3-6,9,12,14H,7-8,10-11,13H2,1-2H3