4-(4-fluorophenyl)-N-[3-nitro-4-[(2-oxidanylcyclohexyl)methylamino]phenyl]sulfonyl-benzamide

Systemtic Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[(2-oxidanylcyclohexyl)methylamino]phenyl]sulfonyl-benzamide Openeye Name: 4-(4-fluorophenyl)-N-[4-[(2-hydroxycyclohexyl)methylamino]-3-nitro-phenyl]sulfonyl-benzamide CAS Name: 4-(4-fluorophenyl)-N-[4-[(2-hydroxycyclohexyl)methylamino]-3-nitrophenyl]sulfonylbenzamide IUPAC Name: 4-(4-fluorophenyl)-N-[4-[(2-hydroxycyclohexyl)methylamino]-3-nitrophenyl]sulfonylbenzamide Traditional Name: 4-(4-fluorophenyl)-N-[4-[(2-hydroxycyclohexyl)methylamino]-3-nitro-phenyl]sulfonyl-benzamide Formula: C26H26FN3O6S MolecularWeight: 527.564543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CNC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-])O

Isomeric SMILES

C1CCC(C(C1)CNC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-])O

InChI

InChI=1S/C26H26FN3O6S/c27-21-11-9-18(10-12-21)17-5-7-19(8-6-17)26(32)29-37(35,36)22-13-14-23(24(15-22)30(33)34)28-16-20-3-1-2-4-25(20)31/h5-15,20,25,28,31H,1-4,16H2,(H,29,32)