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

Systemtic Name: (4-chlorophenyl)methyl-methyl-[2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl]azanium Openeye Name: (4-chlorophenyl)methyl-methyl-[2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl]ammonium CAS Name: [2-[4-[anilino(oxo)methyl]-1-piperazinyl]-2-oxoethyl]-[(4-chlorophenyl)methyl]-methylammonium IUPAC Name: (4-chlorophenyl)methyl-methyl-[2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl]azanium Traditional Name: (4-chlorobenzyl)-[2-keto-2-[4-(phenylcarbamoyl)piperazino]ethyl]-methyl-ammonium Formula: C21H26ClN4O2+ MolecularWeight: 401.90974

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Cl)CC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Cl)CC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25ClN4O2/c1-24(15-17-7-9-18(22)10-8-17)16-20(27)25-11-13-26(14-12-25)21(28)23-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3,(H,23,28)/p+1