(3-methyl-4-methylsulfanyl-phenyl) N-(4-methyl-3-nitro-phenyl)carbamate

Systemtic Name: (3-methyl-4-methylsulfanyl-phenyl) N-(4-methyl-3-nitro-phenyl)carbamate Openeye Name: (3-methyl-4-methylsulfanyl-phenyl) N-(4-methyl-3-nitro-phenyl)carbamate CAS Name: N-(4-methyl-3-nitrophenyl)carbamic acid [3-methyl-4-(methylthio)phenyl] ester IUPAC Name: (3-methyl-4-methylsulfanylphenyl) N-(4-methyl-3-nitrophenyl)carbamate Traditional Name: N-(4-methyl-3-nitro-phenyl)carbamic acid [3-methyl-4-(methylthio)phenyl] ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)OC2=CC(=C(C=C2)SC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)OC2=CC(=C(C=C2)SC)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4S/c1-10-4-5-12(9-14(10)18(20)21)17-16(19)22-13-6-7-15(23-3)11(2)8-13/h4-9H,1-3H3,(H,17,19)