6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-2-prop-2-enyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-2-prop-2-enyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-allyl-6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-2-prop-2-enyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-2-prop-2-enyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-allyl-6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-3,4-dihydro-1H-isoquinoline Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC=C)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC=C)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H26N2O4/c1-4-12-23-13-11-17-14-21(27-2)22(28-3)15-19(17)20(23)10-7-16-5-8-18(9-6-16)24(25)26/h4-6,8-9,14-15,20H,1,7,10-13H2,2-3H3