4-(2,3-dihydro-1H-inden-5-ylsulfanyl)-3-nitro-benzamide

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-ylsulfanyl)-3-nitro-benzamide Openeye Name: 4-indan-5-ylsulfanyl-3-nitro-benzamide CAS Name: 4-(2,3-dihydro-1H-inden-5-ylthio)-3-nitrobenzamide IUPAC Name: 4-(2,3-dihydro-1H-inden-5-ylsulfanyl)-3-nitrobenzamide Traditional Name: 4-(indan-5-ylthio)-3-nitro-benzamide Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O3S/c17-16(19)12-5-7-15(14(9-12)18(20)21)22-13-6-4-10-2-1-3-11(10)8-13/h4-9H,1-3H2,(H2,17,19)