2-methoxy-4-methylsulfanyl-N-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]benzamide

Systemtic Name: 2-methoxy-4-methylsulfanyl-N-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]benzamide Openeye Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methoxy-4-methylsulfanyl-benzamide CAS Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methoxy-4-(methylthio)benzamide IUPAC Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methoxy-4-methylsulfanylbenzamide Traditional Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methoxy-4-(methylthio)benzamide Formula: C17H18N2O5S MolecularWeight: 362.40022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NC[C@H](C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H18N2O5S/c1-24-16-9-13(25-2)7-8-14(16)17(21)18-10-15(20)11-3-5-12(6-4-11)19(22)23/h3-9,15,20H,10H2,1-2H3,(H,18,21)/t15-/m1/s1