2-[(4-iodophenyl)-oxidanyl-methyl]-6-methyl-1-piperidin-1-yl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 2-[(4-iodophenyl)-oxidanyl-methyl]-6-methyl-1-piperidin-1-yl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 2-[hydroxy-(4-iodophenyl)methyl]-6-methyl-1-(1-piperidyl)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 2-[hydroxy-(4-iodophenyl)methyl]-6-methyl-1-(1-piperidinyl)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 2-[hydroxy-(4-iodophenyl)methyl]-6-methyl-1-piperidin-1-yl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 2-[hydroxy-(4-iodophenyl)methyl]-6-methyl-1-piperidino-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C20H24IN3O3 MolecularWeight: 481.32733

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C=CC(N(C2C1=O)N3CCCCC3)C(C4=CC=C(C=C4)I)O

Isomeric SMILES

CN1C(=O)C2C=CC(N(C2C1=O)N3CCCCC3)C(C4=CC=C(C=C4)I)O

InChI

InChI=1S/C20H24IN3O3/c1-22-19(26)15-9-10-16(18(25)13-5-7-14(21)8-6-13)24(17(15)20(22)27)23-11-3-2-4-12-23/h5-10,15-18,25H,2-4,11-12H2,1H3