S-(4-hydroxyphenyl) N-(2-chloranyl-4-nitro-phenyl)carbamothioate

Systemtic Name: S-(4-hydroxyphenyl) N-(2-chloranyl-4-nitro-phenyl)carbamothioate Openeye Name: S-(4-hydroxyphenyl) N-(2-chloro-4-nitro-phenyl)carbamothioate CAS Name: N-(2-chloro-4-nitrophenyl)carbamothioic acid S-(4-hydroxyphenyl) ester IUPAC Name: S-(4-hydroxyphenyl) N-(2-chloro-4-nitrophenyl)carbamothioate Traditional Name: N-(2-chloro-4-nitro-phenyl)thiocarbamic acid S-(4-hydroxyphenyl) ester Formula: C13H9ClN2O4S MolecularWeight: 324.73956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1O)SC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1O)SC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H9ClN2O4S/c14-11-7-8(16(19)20)1-6-12(11)15-13(18)21-10-4-2-9(17)3-5-10/h1-7,17H,(H,15,18)