(4-chloranyl-2-nitro-phenyl)methyl N-(phenylmethyl)carbamodithioate

Systemtic Name: (4-chloranyl-2-nitro-phenyl)methyl N-(phenylmethyl)carbamodithioate Openeye Name: (4-chloro-2-nitro-phenyl)methyl N-benzylcarbamodithioate CAS Name: N-(phenylmethyl)carbamodithioic acid (4-chloro-2-nitrophenyl)methyl ester IUPAC Name: (4-chloro-2-nitrophenyl)methyl N-benzylcarbamodithioate Traditional Name: N-benzylcarbamodithioic acid (4-chloro-2-nitro-benzyl) ester Formula: C15H13ClN2O2S2 MolecularWeight: 352.85892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)SCC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)SCC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H13ClN2O2S2/c16-13-7-6-12(14(8-13)18(19)20)10-22-15(21)17-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,17,21)