1-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone

Systemtic Name: 1-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone Openeye Name: 1-[4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone CAS Name: 1-[4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-2-(3-methylphenoxy)ethanone IUPAC Name: 1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone Traditional Name: 1-[4-(2-chloro-6-nitro-phenyl)piperazino]-2-(3-methylphenoxy)ethanone Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O4/c1-14-4-2-5-15(12-14)27-13-18(24)21-8-10-22(11-9-21)19-16(20)6-3-7-17(19)23(25)26/h2-7,12H,8-11,13H2,1H3