N-(4-ethylphenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-ethylphenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(4-ethylphenyl)-4-(p-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-ethylphenyl)-4-[(4-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-ethylphenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(4-ethylphenyl)-4-(4-methylbenzyl)piperazin-4-ium-1-carboxamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H27N3O/c1-3-18-8-10-20(11-9-18)22-21(25)24-14-12-23(13-15-24)16-19-6-4-17(2)5-7-19/h4-11H,3,12-16H2,1-2H3,(H,22,25)/p+1