2-[(E)-2-[4-methoxy-3-(2-methylpropoxy)phenyl]ethenyl]quinoline-4-carboxylate

Systemtic Name: 2-[(E)-2-[4-methoxy-3-(2-methylpropoxy)phenyl]ethenyl]quinoline-4-carboxylate Openeye Name: 2-[(E)-2-(3-isobutoxy-4-methoxy-phenyl)vinyl]quinoline-4-carboxylate CAS Name: 2-[(E)-2-[4-methoxy-3-(2-methylpropoxy)phenyl]ethenyl]-4-quinolinecarboxylate IUPAC Name: 2-[(E)-2-[4-methoxy-3-(2-methylpropoxy)phenyl]ethenyl]quinoline-4-carboxylate Traditional Name: 2-[(E)-2-(3-isobutoxy-4-methoxy-phenyl)vinyl]cinchoninate Formula: C23H22NO4- MolecularWeight: 376.42508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)C=CC2=NC3=CC=CC=C3C(=C2)C(=O)[O-])OC

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)/C=C/C2=NC3=CC=CC=C3C(=C2)C(=O)[O-])OC

InChI

InChI=1S/C23H23NO4/c1-15(2)14-28-22-12-16(9-11-21(22)27-3)8-10-17-13-19(23(25)26)18-6-4-5-7-20(18)24-17/h4-13,15H,14H2,1-3H3,(H,25,26)/p-1/b10-8+