N-(3-ethylpentan-3-yl)-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-(3-ethylpentan-3-yl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(1,1-diethylpropyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(3-ethylpentan-3-yl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(3-ethylpentan-3-yl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(1,1-diethylpropyl)-4-(methylthio)-3-nitro-benzamide Formula: C15H22N2O3S MolecularWeight: 310.41178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC)NC(=O)C1=CC(=C(C=C1)SC)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)(CC)NC(=O)C1=CC(=C(C=C1)SC)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O3S/c1-5-15(6-2,7-3)16-14(18)11-8-9-13(21-4)12(10-11)17(19)20/h8-10H,5-7H2,1-4H3,(H,16,18)