O-propan-2-yl N-(4-methyl-2-nitro-phenyl)carbamothioate

Systemtic Name: O-propan-2-yl N-(4-methyl-2-nitro-phenyl)carbamothioate Openeye Name: O-isopropyl N-(4-methyl-2-nitro-phenyl)carbamothioate CAS Name: N-(4-methyl-2-nitrophenyl)carbamothioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl N-(4-methyl-2-nitrophenyl)carbamothioate Traditional Name: N-(4-methyl-2-nitro-phenyl)thiocarbamic acid O-isopropyl ester Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)OC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)OC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O3S/c1-7(2)16-11(17)12-9-5-4-8(3)6-10(9)13(14)15/h4-7H,1-3H3,(H,12,17)