N-(3,5-dimethylphenyl)-4-methyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-methyl-piperazin-4-ium-1-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-4-methyl-piperazin-4-ium-1-carboxamide CAS Name: N-(3,5-dimethylphenyl)-4-methyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-4-methylpiperazin-4-ium-1-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-4-methyl-piperazin-4-ium-1-carboxamide Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)N2CC[NH+](CC2)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)N2CC[NH+](CC2)C)C

InChI

InChI=1S/C14H21N3O/c1-11-8-12(2)10-13(9-11)15-14(18)17-6-4-16(3)5-7-17/h8-10H,4-7H2,1-3H3,(H,15,18)/p+1