N-carboxy-N-[[1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]amino]-1-pyridin-2-yl-propan-2-amine oxide

Systemtic Name: N-carboxy-N-[[1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]amino]-1-pyridin-2-yl-propan-2-amine oxide Openeye Name: N-carboxy-N-[[2-[4-(4-chlorophenyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]amino]-1-(2-pyridyl)propan-2-amine oxide CAS Name: N-carboxy-N-[[1-[4-(4-chlorophenyl)-1-piperazinyl]-1-oxopropan-2-yl]amino]-1-(2-pyridinyl)-2-propanamine oxide IUPAC Name: N-carboxy-N-[[1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl]amino]-1-pyridin-2-ylpropan-2-amine oxide Traditional Name: N-carboxy-N-[[2-[4-(4-chlorophenyl)piperazino]-2-keto-1-methyl-ethyl]amino]-1-(2-pyridyl)propan-2-amine oxide Formula: C22H28ClN5O4 MolecularWeight: 461.94182

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=N1)[N+](C(=O)O)(NC(C)C(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl)[O-]

Isomeric SMILES

CC(CC1=CC=CC=N1)[N+](C(=O)O)(NC(C)C(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl)[O-]

InChI

InChI=1S/C22H28ClN5O4/c1-16(15-19-5-3-4-10-24-19)28(32,22(30)31)25-17(2)21(29)27-13-11-26(12-14-27)20-8-6-18(23)7-9-20/h3-10,16-17,25H,11-15H2,1-2H3,(H,30,31)