2-[2-[4-[(4-nitrophenyl)methyl]-4-oxidanyl-piperidin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one

Systemtic Name: 2-[2-[4-[(4-nitrophenyl)methyl]-4-oxidanyl-piperidin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one Openeye Name: 3-hydroxy-2-[2-[4-hydroxy-4-[(4-nitrophenyl)methyl]-1-piperidyl]ethyl]-3H-benzo[de]isoquinolin-1-one CAS Name: 3-hydroxy-2-[2-[4-hydroxy-4-[(4-nitrophenyl)methyl]-1-piperidinyl]ethyl]-3H-benzo[de]isoquinolin-1-one IUPAC Name: 3-hydroxy-2-[2-[4-hydroxy-4-[(4-nitrophenyl)methyl]piperidin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one Traditional Name: 3-hydroxy-2-[2-[4-hydroxy-4-(4-nitrobenzyl)piperidino]ethyl]-3H-benzo[de]isoquinolin-1-one Formula: C26H27N3O5 MolecularWeight: 461.50968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=C(C=C2)[N+](=O)[O-])O)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

Isomeric SMILES

C1CN(CCC1(CC2=CC=C(C=C2)[N+](=O)[O-])O)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

InChI

InChI=1S/C26H27N3O5/c30-24-21-5-1-3-19-4-2-6-22(23(19)21)25(31)28(24)16-15-27-13-11-26(32,12-14-27)17-18-7-9-20(10-8-18)29(33)34/h1-10,24,30,32H,11-17H2