4-[[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-nitro-phenol

Systemtic Name: 4-[[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-nitro-phenol Openeye Name: 4-[[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-nitro-phenol CAS Name: 4-[[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-nitrophenol IUPAC Name: 4-[[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-nitrophenol Traditional Name: 4-[[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-nitro-phenol Formula: C24H23ClN2O5 MolecularWeight: 454.90282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC3=CC(=C(C=C3)O)[N+](=O)[O-])C4=CC(=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC3=CC(=C(C=C3)O)[N+](=O)[O-])C4=CC(=CC=C4)Cl)OC

InChI

InChI=1S/C24H23ClN2O5/c1-31-22-12-16-8-9-26(14-15-6-7-21(28)20(10-15)27(29)30)24(19(16)13-23(22)32-2)17-4-3-5-18(25)11-17/h3-7,10-13,24,28H,8-9,14H2,1-2H3