(E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-ethoxy-4-nitro-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-ethoxy-4-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-ethoxy-4-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-ethoxy-4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-ethoxy-4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-ethoxy-4-nitro-phenyl)prop-2-en-1-one Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O6/c1-4-30-19-11-15(5-7-18(19)24(26)27)6-8-22(25)23-10-9-16-12-20(28-2)21(29-3)13-17(16)14-23/h5-8,11-13H,4,9-10,14H2,1-3H3/b8-6+