[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-[4-(3-chlorophenyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-methyl-propyl]ammonium Formula: C15H23ClN3O+ MolecularWeight: 296.81562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)[NH3+]

InChI

InChI=1S/C15H22ClN3O/c1-11(2)14(17)15(20)19-8-6-18(7-9-19)13-5-3-4-12(16)10-13/h3-5,10-11,14H,6-9,17H2,1-2H3/p+1/t14-/m0/s1