butyl 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-6-methoxy-quinoline-4-carboxylate

Systemtic Name: butyl 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-6-methoxy-quinoline-4-carboxylate Openeye Name: butyl 2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-6-methoxy-quinoline-4-carboxylate CAS Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-6-methoxy-4-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-6-methoxyquinoline-4-carboxylate Traditional Name: 2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-6-methoxy-cinchoninic acid butyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)OC)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)OC)/C=C/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H27NO5/c1-5-6-13-31-25(27)21-15-18(26-22-11-10-19(28-2)16-20(21)22)9-7-17-8-12-23(29-3)24(14-17)30-4/h7-12,14-16H,5-6,13H2,1-4H3/b9-7+