(E)-3-[4-methoxy-3-[(5-nitroquinolin-8-yl)oxymethyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-methoxy-3-[(5-nitroquinolin-8-yl)oxymethyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-methoxy-3-[(5-nitro-8-quinolyl)oxymethyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-methoxy-3-[(5-nitro-8-quinolinyl)oxymethyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-methoxy-3-[(5-nitroquinolin-8-yl)oxymethyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-methoxy-3-[(5-nitro-8-quinolyl)oxymethyl]phenyl]acrylic acid Formula: C20H16N2O6 MolecularWeight: 380.35084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)O)COC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)O)COC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C20H16N2O6/c1-27-17-7-4-13(5-9-19(23)24)11-14(17)12-28-18-8-6-16(22(25)26)15-3-2-10-21-20(15)18/h2-11H,12H2,1H3,(H,23,24)/b9-5+