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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

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