1-[6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenoxy-propan-1-one

Systemtic Name: 1-[6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenoxy-propan-1-one Openeye Name: 1-[6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenoxy-propan-1-one CAS Name: 1-[6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenoxy-1-propanone IUPAC Name: 1-[6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenoxypropan-1-one Traditional Name: 1-[6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenoxy-propan-1-one Formula: C27H28N2O7 MolecularWeight: 492.52042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC(=C(C=C2C1COC3=CC=C(C=C3)[N+](=O)[O-])OC)OC)OC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCC2=CC(=C(C=C2C1COC3=CC=C(C=C3)[N+](=O)[O-])OC)OC)OC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O7/c1-18(36-22-7-5-4-6-8-22)27(30)28-14-13-19-15-25(33-2)26(34-3)16-23(19)24(28)17-35-21-11-9-20(10-12-21)29(31)32/h4-12,15-16,18,24H,13-14,17H2,1-3H3