2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]-1-[4-(2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(2-chloro-5-nitro-benzyl)-methyl-amino]-1-[4-(2-pyridyl)piperazino]ethanone Formula: C19H22ClN5O3 MolecularWeight: 403.86268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C19H22ClN5O3/c1-22(13-15-12-16(25(27)28)5-6-17(15)20)14-19(26)24-10-8-23(9-11-24)18-4-2-3-7-21-18/h2-7,12H,8-11,13-14H2,1H3