4-(3,5-dimethoxyphenyl)-N-(2-methoxyquinolin-3-yl)-1-(phenylmethyl)piperazin-1-ium-1-carboxamide

Systemtic Name: 4-(3,5-dimethoxyphenyl)-N-(2-methoxyquinolin-3-yl)-1-(phenylmethyl)piperazin-1-ium-1-carboxamide Openeye Name: 1-benzyl-4-(3,5-dimethoxyphenyl)-N-(2-methoxy-3-quinolyl)piperazin-1-ium-1-carboxamide CAS Name: 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-3-quinolinyl)-1-(phenylmethyl)-1-piperazin-1-iumcarboxamide IUPAC Name: 1-benzyl-4-(3,5-dimethoxyphenyl)-N-(2-methoxyquinolin-3-yl)piperazin-1-ium-1-carboxamide Traditional Name: 1-benzyl-4-(3,5-dimethoxyphenyl)-N-(2-methoxy-3-quinolyl)piperazin-1-ium-1-carboxamide Formula: C30H33N4O4+ MolecularWeight: 513.60742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CC[N+](CC2)(CC3=CC=CC=C3)C(=O)NC4=CC5=CC=CC=C5N=C4OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2CC[N+](CC2)(CC3=CC=CC=C3)C(=O)NC4=CC5=CC=CC=C5N=C4OC)OC

InChI

InChI=1S/C30H32N4O4/c1-36-25-18-24(19-26(20-25)37-2)33-13-15-34(16-14-33,21-22-9-5-4-6-10-22)30(35)32-28-17-23-11-7-8-12-27(23)31-29(28)38-3/h4-12,17-20H,13-16,21H2,1-3H3/p+1