(3,5-dinitrophenyl)-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(4-benzyloxyphenyl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone CAS Name: (3,5-dinitrophenyl)-[4-(4-phenylmethoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (3,5-dinitrophenyl)-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(4-benzoxyphenyl)piperazino]-(3,5-dinitrophenyl)methanone Formula: C24H22N4O6 MolecularWeight: 462.45468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N4O6/c29-24(19-14-21(27(30)31)16-22(15-19)28(32)33)26-12-10-25(11-13-26)20-6-8-23(9-7-20)34-17-18-4-2-1-3-5-18/h1-9,14-16H,10-13,17H2