2-(3,4-dimethoxyphenyl)ethyl-[[2-(4-ethoxycarbonylpiperazin-1-yl)-6-methyl-quinolin-3-yl]methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[[2-(4-ethoxycarbonylpiperazin-1-yl)-6-methyl-quinolin-3-yl]methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[[2-(4-ethoxycarbonylpiperazin-1-yl)-6-methyl-3-quinolyl]methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[[2-(4-ethoxycarbonyl-1-piperazinyl)-6-methyl-3-quinolinyl]methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[[2-(4-ethoxycarbonylpiperazin-1-yl)-6-methylquinolin-3-yl]methyl]azanium Traditional Name: [2-(4-carbethoxypiperazino)-6-methyl-3-quinolyl]methyl-homoveratryl-ammonium Formula: C28H37N4O4+ MolecularWeight: 493.61778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)C[NH2+]CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)C[NH2+]CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H36N4O4/c1-5-36-28(33)32-14-12-31(13-15-32)27-23(18-22-16-20(2)6-8-24(22)30-27)19-29-11-10-21-7-9-25(34-3)26(17-21)35-4/h6-9,16-18,29H,5,10-15,19H2,1-4H3/p+1