O-[2-(4-chlorophenyl)ethyl] N-(4-nitrophenyl)carbamothioate

Systemtic Name: O-[2-(4-chlorophenyl)ethyl] N-(4-nitrophenyl)carbamothioate Openeye Name: O-[2-(4-chlorophenyl)ethyl] N-(4-nitrophenyl)carbamothioate CAS Name: N-(4-nitrophenyl)carbamothioic acid O-[2-(4-chlorophenyl)ethyl] ester IUPAC Name: O-[2-(4-chlorophenyl)ethyl] N-(4-nitrophenyl)carbamothioate Traditional Name: N-(4-nitrophenyl)thiocarbamic acid O-[2-(4-chlorophenyl)ethyl] ester Formula: C15H13ClN2O3S MolecularWeight: 336.79332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCOC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CCOC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN2O3S/c16-12-3-1-11(2-4-12)9-10-21-15(22)17-13-5-7-14(8-6-13)18(19)20/h1-8H,9-10H2,(H,17,22)