3-methyl-N-pentyl-4-piperazin-4-ium-1-yl-benzamide

Systemtic Name: 3-methyl-N-pentyl-4-piperazin-4-ium-1-yl-benzamide Openeye Name: 3-methyl-N-pentyl-4-piperazin-4-ium-1-yl-benzamide CAS Name: 3-methyl-N-pentyl-4-(1-piperazin-4-iumyl)benzamide IUPAC Name: 3-methyl-N-pentyl-4-piperazin-4-ium-1-ylbenzamide Traditional Name: N-amyl-3-methyl-4-piperazin-4-ium-1-yl-benzamide Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=C(C=C1)N2CC[NH2+]CC2)C

Isomeric SMILES

CCCCCNC(=O)C1=CC(=C(C=C1)N2CC[NH2+]CC2)C

InChI

InChI=1S/C17H27N3O/c1-3-4-5-8-19-17(21)15-6-7-16(14(2)13-15)20-11-9-18-10-12-20/h6-7,13,18H,3-5,8-12H2,1-2H3,(H,19,21)/p+1