1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-3-(2,4-dimethylphenyl)-1-propanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-3-(2,4-dimethylphenyl)propan-1-one Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O3/c1-15-3-4-17(16(2)13-15)5-8-21(26)24-11-9-23(10-12-24)19-7-6-18(22)14-20(19)25(27)28/h3-4,6-7,13-14H,5,8-12H2,1-2H3