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

Systemtic Name: 1-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone Openeye Name: 1-[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone CAS Name: 1-[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-2-(3-methylphenoxy)ethanone IUPAC Name: 1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone Traditional Name: 1-[4-(2-chloro-4-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=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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