(7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-prop-2-enoate

Systemtic Name: (7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-prop-2-enoate Openeye Name: (7-nitro-8-quinolyl) (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-2-propenoic acid (7-nitro-8-quinolinyl) ester IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)-2-methylprop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-acrylic acid (7-nitro-8-quinolyl) ester Formula: C20H14N2O6 MolecularWeight: 378.33496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=C(C=C1)OCO2)C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C1=CC2=C(C=C1)OCO2)/C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N2O6/c1-12(9-13-4-7-16-17(10-13)27-11-26-16)20(23)28-19-15(22(24)25)6-5-14-3-2-8-21-18(14)19/h2-10H,11H2,1H3/b12-9+