[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[4-(m-tolylmethyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: [2-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: [2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[4-(3-methylbenzyl)piperazino]ethyl]ammonium Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O/c1-12-3-2-4-13(9-12)11-16-5-7-17(8-6-16)14(18)10-15/h2-4,9H,5-8,10-11,15H2,1H3/p+1