3-nitro-N-(4-oxidanylcyclohexyl)-4-phenylsulfanyl-benzamide

Systemtic Name: 3-nitro-N-(4-oxidanylcyclohexyl)-4-phenylsulfanyl-benzamide Openeye Name: N-(4-hydroxycyclohexyl)-3-nitro-4-phenylsulfanyl-benzamide CAS Name: N-(4-hydroxycyclohexyl)-3-nitro-4-(phenylthio)benzamide IUPAC Name: N-(4-hydroxycyclohexyl)-3-nitro-4-phenylsulfanylbenzamide Traditional Name: N-(4-hydroxycyclohexyl)-3-nitro-4-(phenylthio)benzamide Formula: C19H20N2O4S MolecularWeight: 372.4381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H20N2O4S/c22-15-9-7-14(8-10-15)20-19(23)13-6-11-18(17(12-13)21(24)25)26-16-4-2-1-3-5-16/h1-6,11-12,14-15,22H,7-10H2,(H,20,23)