4-methyl-N-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]benzamide

Systemtic Name: 4-methyl-N-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]benzamide Openeye Name: N-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-4-methyl-benzamide CAS Name: 4-methyl-N-[2-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]benzamide IUPAC Name: N-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-4-methylbenzamide Traditional Name: N-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-4-methyl-benzamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O/c1-18-7-9-20(10-8-18)21(25)22-11-12-23-13-15-24(16-14-23)17-19-5-3-2-4-6-19/h2-10H,11-17H2,1H3,(H,22,25)/p+1