2-[[1-[(3-nitrophenyl)methyl]piperidin-4-yl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[1-[(3-nitrophenyl)methyl]piperidin-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[1-[(3-nitrophenyl)methyl]-4-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[1-[(3-nitrophenyl)methyl]-4-piperidinyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[[1-[(3-nitrophenyl)methyl]piperidin-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[[1-(3-nitrobenzyl)-4-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCC3=CC=CC=C3C2)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CN2CCC3=CC=CC=C3C2)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O2/c26-25(27)22-7-3-4-19(14-22)16-23-11-8-18(9-12-23)15-24-13-10-20-5-1-2-6-21(20)17-24/h1-7,14,18H,8-13,15-17H2