[6-[4-(3-methylphenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-[4-(3-methylphenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]azanium Openeye Name: [6-[4-(m-tolyl)piperazin-1-yl]-6-oxo-hexyl]ammonium CAS Name: [6-[4-(3-methylphenyl)-1-piperazinyl]-6-oxohexyl]ammonium IUPAC Name: [6-[4-(3-methylphenyl)piperazin-1-yl]-6-oxohexyl]azanium Traditional Name: [6-keto-6-[4-(m-tolyl)piperazino]hexyl]ammonium Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CCCCC[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CCCCC[NH3+]

InChI

InChI=1S/C17H27N3O/c1-15-6-5-7-16(14-15)19-10-12-20(13-11-19)17(21)8-3-2-4-9-18/h5-7,14H,2-4,8-13,18H2,1H3/p+1