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

Systemtic Name: N-(4-ethanoylphenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(4-acetylphenyl)-4-(p-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-acetylphenyl)-4-[(4-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-acetylphenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(4-acetylphenyl)-4-(4-methylbenzyl)piperazin-4-ium-1-carboxamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H25N3O2/c1-16-3-5-18(6-4-16)15-23-11-13-24(14-12-23)21(26)22-20-9-7-19(8-10-20)17(2)25/h3-10H,11-15H2,1-2H3,(H,22,26)/p+1