(2-chloranyl-5-nitro-phenyl)-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (2-chloranyl-5-nitro-phenyl)-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(4-benzyloxyphenyl)piperazin-1-yl]-(2-chloro-5-nitro-phenyl)methanone CAS Name: (2-chloro-5-nitrophenyl)-[4-(4-phenylmethoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-nitrophenyl)-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(4-benzoxyphenyl)piperazino]-(2-chloro-5-nitro-phenyl)methanone Formula: C24H22ClN3O4 MolecularWeight: 451.90218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H22ClN3O4/c25-23-11-8-20(28(30)31)16-22(23)24(29)27-14-12-26(13-15-27)19-6-9-21(10-7-19)32-17-18-4-2-1-3-5-18/h1-11,16H,12-15,17H2