S-(4-hydroxyphenyl) N-(2-methyl-5-nitro-phenyl)carbamothioate

Systemtic Name: S-(4-hydroxyphenyl) N-(2-methyl-5-nitro-phenyl)carbamothioate Openeye Name: S-(4-hydroxyphenyl) N-(2-methyl-5-nitro-phenyl)carbamothioate CAS Name: N-(2-methyl-5-nitrophenyl)carbamothioic acid S-(4-hydroxyphenyl) ester IUPAC Name: S-(4-hydroxyphenyl) N-(2-methyl-5-nitrophenyl)carbamothioate Traditional Name: N-(2-methyl-5-nitro-phenyl)thiocarbamic acid S-(4-hydroxyphenyl) ester Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)SC2=CC=C(C=C2)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)SC2=CC=C(C=C2)O

InChI

InChI=1S/C14H12N2O4S/c1-9-2-3-10(16(19)20)8-13(9)15-14(18)21-12-6-4-11(17)5-7-12/h2-8,17H,1H3,(H,15,18)