1-(4,4-diphenylheptyl)-6,7-dimethoxy-1-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-isoquinoline

Systemtic Name: 1-(4,4-diphenylheptyl)-6,7-dimethoxy-1-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-isoquinoline Openeye Name: 1-(4,4-diphenylheptyl)-6,7-dimethoxy-1-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-isoquinoline CAS Name: 1-(4,4-diphenylheptyl)-6,7-dimethoxy-1-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-isoquinoline IUPAC Name: 1-(4,4-diphenylheptyl)-6,7-dimethoxy-1-[(4-nitrophenyl)methyl]-3,4-dihydro-2H-isoquinoline Traditional Name: 1-(4,4-diphenylheptyl)-6,7-dimethoxy-1-(4-nitrobenzyl)-3,4-dihydro-2H-isoquinoline Formula: C37H42N2O4 MolecularWeight: 578.74038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCC1(C2=CC(=C(C=C2CCN1)OC)OC)CC3=CC=C(C=C3)[N+](=O)[O-])(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC(CCCC1(C2=CC(=C(C=C2CCN1)OC)OC)CC3=CC=C(C=C3)[N+](=O)[O-])(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H42N2O4/c1-4-21-36(30-12-7-5-8-13-30,31-14-9-6-10-15-31)22-11-23-37(27-28-16-18-32(19-17-28)39(40)41)33-26-35(43-3)34(42-2)25-29(33)20-24-38-37/h5-10,12-19,25-26,38H,4,11,20-24,27H2,1-3H3