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

Systemtic Name: [2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: [2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: [2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]azanium Traditional Name: [2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]ammonium Formula: C12H17ClN3O+ MolecularWeight: 254.73588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C[NH3+]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C[NH3+]

InChI

InChI=1S/C12H16ClN3O/c13-10-2-1-3-11(8-10)15-4-6-16(7-5-15)12(17)9-14/h1-3,8H,4-7,9,14H2/p+1