3-methyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide

Systemtic Name: 3-methyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Openeye Name: 3-methyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide CAS Name: 3-methyl-N-[4-(1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3-methyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Traditional Name: 3-methyl-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C18H21N3O/c1-14-3-2-4-15(13-14)18(22)20-16-5-7-17(8-6-16)21-11-9-19-10-12-21/h2-8,13,19H,9-12H2,1H3,(H,20,22)/p+1