(2,2-dimethyl-3-oxidanylidene-3-piperazin-1-yl-propyl)-ethyl-(phenylmethyl)azanium

Systemtic Name: (2,2-dimethyl-3-oxidanylidene-3-piperazin-1-yl-propyl)-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-(2,2-dimethyl-3-oxo-3-piperazin-1-yl-propyl)-ethyl-ammonium CAS Name: [2,2-dimethyl-3-oxo-3-(1-piperazinyl)propyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-(2,2-dimethyl-3-oxo-3-piperazin-1-ylpropyl)-ethylazanium Traditional Name: benzyl-ethyl-(3-keto-2,2-dimethyl-3-piperazino-propyl)ammonium Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(C)(C)C(=O)N2CCNCC2

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(C)(C)C(=O)N2CCNCC2

InChI

InChI=1S/C18H29N3O/c1-4-20(14-16-8-6-5-7-9-16)15-18(2,3)17(22)21-12-10-19-11-13-21/h5-9,19H,4,10-15H2,1-3H3/p+1