[4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]azanium Openeye Name: [4-oxo-4-[4-(p-tolylmethyl)piperazin-1-yl]butyl]ammonium CAS Name: [4-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-4-oxobutyl]ammonium IUPAC Name: [4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-4-oxobutyl]azanium Traditional Name: [4-keto-4-[4-(4-methylbenzyl)piperazino]butyl]ammonium Formula: C16H26N3O+ MolecularWeight: 276.39714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)CCC[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)CCC[NH3+]

InChI

InChI=1S/C16H25N3O/c1-14-4-6-15(7-5-14)13-18-9-11-19(12-10-18)16(20)3-2-8-17/h4-7H,2-3,8-13,17H2,1H3/p+1