2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(4-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5S/c1-11-2-3-12(8-14(11)19(21)22)18-17(20)10-25-13-4-5-15-16(9-13)24-7-6-23-15/h2-5,8-9H,6-7,10H2,1H3,(H,18,20)