[2-[(E)-2-(2-acetyloxy-5-methoxy-3-nitro-phenyl)ethenyl]quinolin-4-yl] ethanoate

Systemtic Name: [2-[(E)-2-(2-acetyloxy-5-methoxy-3-nitro-phenyl)ethenyl]quinolin-4-yl] ethanoate Openeye Name: [2-[(E)-2-(2-acetoxy-5-methoxy-3-nitro-phenyl)vinyl]-4-quinolyl] acetate CAS Name: acetic acid [2-[(E)-2-(2-acetyloxy-5-methoxy-3-nitrophenyl)ethenyl]-4-quinolinyl] ester IUPAC Name: [2-[(E)-2-(2-acetyloxy-5-methoxy-3-nitrophenyl)ethenyl]quinolin-4-yl] acetate Traditional Name: acetic acid [2-[(E)-2-(2-acetoxy-5-methoxy-3-nitro-phenyl)vinyl]-4-quinolyl] ester Formula: C22H18N2O7 MolecularWeight: 422.38752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=NC2=CC=CC=C21)C=CC3=CC(=CC(=C3OC(=O)C)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)OC1=CC(=NC2=CC=CC=C21)/C=C/C3=CC(=CC(=C3OC(=O)C)[N+](=O)[O-])OC

InChI

InChI=1S/C22H18N2O7/c1-13(25)30-21-11-16(23-19-7-5-4-6-18(19)21)9-8-15-10-17(29-3)12-20(24(27)28)22(15)31-14(2)26/h4-12H,1-3H3/b9-8+