N-(3-methylbutyl)-2-(4-piperazin-4-ium-1-ylphenyl)ethanamide

Systemtic Name: N-(3-methylbutyl)-2-(4-piperazin-4-ium-1-ylphenyl)ethanamide Openeye Name: N-isopentyl-2-(4-piperazin-4-ium-1-ylphenyl)acetamide CAS Name: N-(3-methylbutyl)-2-[4-(1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: N-(3-methylbutyl)-2-(4-piperazin-4-ium-1-ylphenyl)acetamide Traditional Name: N-isoamyl-2-(4-piperazin-4-ium-1-ylphenyl)acetamide Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CC1=CC=C(C=C1)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)CCNC(=O)CC1=CC=C(C=C1)N2CC[NH2+]CC2

InChI

InChI=1S/C17H27N3O/c1-14(2)7-8-19-17(21)13-15-3-5-16(6-4-15)20-11-9-18-10-12-20/h3-6,14,18H,7-13H2,1-2H3,(H,19,21)/p+1