methyl 4-(3,4-dimethoxyphenyl)-5-methoxy-2-[(E)-4-(1-methylimidazol-2-yl)but-1-enyl]quinoline-3-carboperoxoate

Systemtic Name: methyl 4-(3,4-dimethoxyphenyl)-5-methoxy-2-[(E)-4-(1-methylimidazol-2-yl)but-1-enyl]quinoline-3-carboperoxoate Openeye Name: methyl 4-(3,4-dimethoxyphenyl)-5-methoxy-2-[(E)-4-(1-methylimidazol-2-yl)but-1-enyl]quinoline-3-carboperoxoate CAS Name: 4-(3,4-dimethoxyphenyl)-5-methoxy-2-[(E)-4-(1-methyl-2-imidazolyl)but-1-enyl]-3-quinolinecarboperoxoic acid methyl ester IUPAC Name: methyl 4-(3,4-dimethoxyphenyl)-5-methoxy-2-[(E)-4-(1-methylimidazol-2-yl)but-1-enyl]quinoline-3-carboperoxoate Traditional Name: 4-(3,4-dimethoxyphenyl)-5-methoxy-2-[(E)-4-(1-methylimidazol-2-yl)but-1-enyl]quinoline-3-carboperoxoic acid methyl ester Formula: C28H29N3O6 MolecularWeight: 503.54636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CCC=CC2=C(C(=C3C(=N2)C=CC=C3OC)C4=CC(=C(C=C4)OC)OC)C(=O)OOC

Isomeric SMILES

CN1C=CN=C1CC/C=C/C2=C(C(=C3C(=N2)C=CC=C3OC)C4=CC(=C(C=C4)OC)OC)C(=O)OOC

InChI

InChI=1S/C28H29N3O6/c1-31-16-15-29-24(31)12-7-6-9-20-27(28(32)37-36-5)25(18-13-14-21(33-2)23(17-18)35-4)26-19(30-20)10-8-11-22(26)34-3/h6,8-11,13-17H,7,12H2,1-5H3/b9-6+