2-[4-[4-(2-methoxyphenyl)-4-oxidanyl-piperidin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-[4-(2-methoxyphenyl)-4-oxidanyl-piperidin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-[4-hydroxy-4-(2-methoxyphenyl)-1-piperidyl]butyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-[4-hydroxy-4-(2-methoxyphenyl)-1-piperidinyl]butyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-[4-hydroxy-4-(2-methoxyphenyl)piperidin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-[4-hydroxy-4-(2-methoxyphenyl)piperidino]butyl]benzo[de]isoquinoline-1,3-quinone Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2(CCN(CC2)CCCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)O

Isomeric SMILES

COC1=CC=CC=C1C2(CCN(CC2)CCCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)O

InChI

InChI=1S/C28H30N2O4/c1-34-24-13-3-2-12-23(24)28(33)14-18-29(19-15-28)16-4-5-17-30-26(31)21-10-6-8-20-9-7-11-22(25(20)21)27(30)32/h2-3,6-13,33H,4-5,14-19H2,1H3