N-(3-chloranyl-2-methyl-phenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-(p-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-4-[(4-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-(4-methylbenzyl)piperazin-4-ium-1-carboxamide Formula: C20H25ClN3O+ MolecularWeight: 358.885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O/c1-15-6-8-17(9-7-15)14-23-10-12-24(13-11-23)20(25)22-19-5-3-4-18(21)16(19)2/h3-9H,10-14H2,1-2H3,(H,22,25)/p+1