(7-nitroquinolin-8-yl) (E)-3-(3,4-dimethoxyphenyl)-2-methyl-prop-2-enoate

Systemtic Name: (7-nitroquinolin-8-yl) (E)-3-(3,4-dimethoxyphenyl)-2-methyl-prop-2-enoate Openeye Name: (7-nitro-8-quinolyl) (E)-3-(3,4-dimethoxyphenyl)-2-methyl-prop-2-enoate CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-methyl-2-propenoic acid (7-nitro-8-quinolinyl) ester IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(3,4-dimethoxyphenyl)-2-methylprop-2-enoate Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-2-methyl-acrylic acid (7-nitro-8-quinolyl) ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=C(C=C1)OC)OC)C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C1=CC(=C(C=C1)OC)OC)/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6/c1-13(11-14-6-9-17(27-2)18(12-14)28-3)21(24)29-20-16(23(25)26)8-7-15-5-4-10-22-19(15)20/h4-12H,1-3H3/b13-11+