[4-[4-(4-chloranyl-2-nitro-phenoxy)phenyl]carbonylpiperazin-1-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [4-[4-(4-chloranyl-2-nitro-phenoxy)phenyl]carbonylpiperazin-1-yl]-(4-methoxyphenyl)methanone Openeye Name: [4-[4-(4-chloro-2-nitro-phenoxy)benzoyl]piperazin-1-yl]-(4-methoxyphenyl)methanone CAS Name: [4-[[4-(4-chloro-2-nitrophenoxy)phenyl]-oxomethyl]-1-piperazinyl]-(4-methoxyphenyl)methanone IUPAC Name: [4-[4-(4-chloro-2-nitrophenoxy)benzoyl]piperazin-1-yl]-(4-methoxyphenyl)methanone Traditional Name: [4-[4-(4-chloro-2-nitro-phenoxy)benzoyl]piperazino]-(4-methoxyphenyl)methanone Formula: C25H22ClN3O6 MolecularWeight: 495.91168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H22ClN3O6/c1-34-20-7-2-17(3-8-20)24(30)27-12-14-28(15-13-27)25(31)18-4-9-21(10-5-18)35-23-11-6-19(26)16-22(23)29(32)33/h2-11,16H,12-15H2,1H3