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

Systemtic Name: 1-(cyclopropylmethyl)-4-(3,5-dimethoxyphenyl)-N-(2-methoxyquinolin-3-yl)piperazin-1-ium-1-carboxamide Openeye Name: 1-(cyclopropylmethyl)-4-(3,5-dimethoxyphenyl)-N-(2-methoxy-3-quinolyl)piperazin-1-ium-1-carboxamide CAS Name: 1-(cyclopropylmethyl)-4-(3,5-dimethoxyphenyl)-N-(2-methoxy-3-quinolinyl)-1-piperazin-1-iumcarboxamide IUPAC Name: 1-(cyclopropylmethyl)-4-(3,5-dimethoxyphenyl)-N-(2-methoxyquinolin-3-yl)piperazin-1-ium-1-carboxamide Traditional Name: 1-(cyclopropylmethyl)-4-(3,5-dimethoxyphenyl)-N-(2-methoxy-3-quinolyl)piperazin-1-ium-1-carboxamide Formula: C27H33N4O4+ MolecularWeight: 477.57532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CC[N+](CC2)(CC3CC3)C(=O)NC4=CC5=CC=CC=C5N=C4OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2CC[N+](CC2)(CC3CC3)C(=O)NC4=CC5=CC=CC=C5N=C4OC)OC

InChI

InChI=1S/C27H32N4O4/c1-33-22-15-21(16-23(17-22)34-2)30-10-12-31(13-11-30,18-19-8-9-19)27(32)29-25-14-20-6-4-5-7-24(20)28-26(25)35-3/h4-7,14-17,19H,8-13,18H2,1-3H3/p+1