2-(4-chloranylphenoxy)-2-methyl-1-[4-(2-nitrophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-1-[4-(2-nitrophenyl)piperazin-1-yl]propan-1-one Openeye Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(2-nitrophenyl)piperazin-1-yl]propan-1-one CAS Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(2-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(2-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(2-nitrophenyl)piperazino]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=CC=CC=C2[N+](=O)[O-])OC3=CC=C(C=C3)Cl

Isomeric SMILES

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

InChI

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