2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]ethanamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2-indan-5-ylsulfanyl-acetamide CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-N-[(2-hydroxy-5-nitrophenyl)methyl]acetamide IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]acetamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2-(indan-5-ylthio)acetamide Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H18N2O4S/c21-17-7-5-15(20(23)24)8-14(17)10-19-18(22)11-25-16-6-4-12-2-1-3-13(12)9-16/h4-9,21H,1-3,10-11H2,(H,19,22)