[2-(3-chlorophenyl)piperazin-1-yl]oxycarbonyl-(4-methylpentan-2-yl)-oxidanylidene-azanium

Systemtic Name: [2-(3-chlorophenyl)piperazin-1-yl]oxycarbonyl-(4-methylpentan-2-yl)-oxidanylidene-azanium Openeye Name: [2-(3-chlorophenyl)piperazin-1-yl]oxycarbonyl-(1,3-dimethylbutyl)-oxo-ammonium CAS Name: [[2-(3-chlorophenyl)-1-piperazinyl]oxy-oxomethyl]-(4-methylpentan-2-yl)-oxoammonium IUPAC Name: [2-(3-chlorophenyl)piperazin-1-yl]oxycarbonyl-(4-methylpentan-2-yl)-oxoazanium Traditional Name: [2-(3-chlorophenyl)piperazino]oxycarbonyl-(1,3-dimethylbutyl)-keto-ammonium Formula: C17H25ClN3O3+ MolecularWeight: 354.8517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)[N+](=O)C(=O)ON1CCNCC1C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CC(C)[N+](=O)C(=O)ON1CCNCC1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H25ClN3O3/c1-12(2)9-13(3)21(23)17(22)24-20-8-7-19-11-16(20)14-5-4-6-15(18)10-14/h4-6,10,12-13,16,19H,7-9,11H2,1-3H3/q+1