1-[(Z)-1-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)ethenyl]-6,7-dimethoxy-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium

Systemtic Name: 1-[(Z)-1-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)ethenyl]-6,7-dimethoxy-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium Openeye Name: 2-benzyl-1-[(Z)-1-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)vinyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium CAS Name: 1-[(Z)-1-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)ethenyl]-6,7-dimethoxy-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium IUPAC Name: 2-benzyl-1-[(Z)-1-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)ethenyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium Traditional Name: 2-benzyl-1-[(Z)-1-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)vinyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium Formula: C34H33N2O6+ MolecularWeight: 565.63562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C3=[N+](CCC4=CC(=C(C=C43)OC)OC)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C3=[N+](CCC4=CC(=C(C=C43)OC)OC)CC5=CC=CC=C5)OC

InChI

InChI=1S/C34H33N2O6/c1-39-30-15-12-25(19-31(30)40-2)28(18-23-10-13-27(14-11-23)36(37)38)34-29-21-33(42-4)32(41-3)20-26(29)16-17-35(34)22-24-8-6-5-7-9-24/h5-15,18-21H,16-17,22H2,1-4H3/q+1/b28-18-