1-[4-(3-chlorophenyl)piperazin-1-yl]-3-[(4-imidazol-1-yl-2-nitro-phenyl)amino]propan-1-one

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-[(4-imidazol-1-yl-2-nitro-phenyl)amino]propan-1-one Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-imidazol-1-yl-2-nitro-anilino)propan-1-one CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-3-[4-(1-imidazolyl)-2-nitroanilino]-1-propanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-imidazol-1-yl-2-nitroanilino)propan-1-one Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-3-(4-imidazol-1-yl-2-nitro-anilino)propan-1-one Formula: C22H23ClN6O3 MolecularWeight: 454.90942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCNC3=C(C=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCNC3=C(C=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23ClN6O3/c23-17-2-1-3-18(14-17)26-10-12-27(13-11-26)22(30)6-7-25-20-5-4-19(15-21(20)29(31)32)28-9-8-24-16-28/h1-5,8-9,14-16,25H,6-7,10-13H2