1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-methyl-2-phenoxy-propan-1-one

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-methyl-2-phenoxy-propan-1-one Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-2-methyl-2-phenoxy-propan-1-one CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-2-methyl-2-phenoxy-1-propanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-methyl-2-phenoxypropan-1-one Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-2-methyl-2-phenoxy-propan-1-one Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O4/c1-20(2,28-16-6-4-3-5-7-16)19(25)23-12-10-22(11-13-23)17-9-8-15(21)14-18(17)24(26)27/h3-9,14H,10-13H2,1-2H3