4-(2-cyanoethyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(2-cyanoethyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-(2-cyanoethyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-(2-cyanoethyl)-N-(4-methoxyphenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-(2-cyanoethyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-(2-cyanoethyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CCC#N

InChI

InChI=1S/C15H20N4O2/c1-21-14-5-3-13(4-6-14)17-15(20)19-11-9-18(10-12-19)8-2-7-16/h3-6H,2,8-12H2,1H3,(H,17,20)/p+1