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

Systemtic Name: 2-[(4-methoxy-3-phenylmethoxy-phenyl)-oxidanyl-methyl]-6-methyl-1-piperidin-1-yl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 2-[(3-benzyloxy-4-methoxy-phenyl)-hydroxy-methyl]-6-methyl-1-(1-piperidyl)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 2-[hydroxy-(4-methoxy-3-phenylmethoxyphenyl)methyl]-6-methyl-1-(1-piperidinyl)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 2-[hydroxy-(4-methoxy-3-phenylmethoxyphenyl)methyl]-6-methyl-1-piperidin-1-yl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 2-[(3-benzoxy-4-methoxy-phenyl)-hydroxy-methyl]-6-methyl-1-piperidino-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C=CC(N(C2C1=O)N3CCCCC3)C(C4=CC(=C(C=C4)OC)OCC5=CC=CC=C5)O

Isomeric SMILES

CN1C(=O)C2C=CC(N(C2C1=O)N3CCCCC3)C(C4=CC(=C(C=C4)OC)OCC5=CC=CC=C5)O

InChI

InChI=1S/C28H33N3O5/c1-29-27(33)21-12-13-22(31(25(21)28(29)34)30-15-7-4-8-16-30)26(32)20-11-14-23(35-2)24(17-20)36-18-19-9-5-3-6-10-19/h3,5-6,9-14,17,21-22,25-26,32H,4,7-8,15-16,18H2,1-2H3