[2-(2-azanyl-1-chloranyl-2-oxidanylidene-ethyl)sulfanyl-5-chloranyl-3-methanoyl-phenyl] benzoate

Systemtic Name: [2-(2-azanyl-1-chloranyl-2-oxidanylidene-ethyl)sulfanyl-5-chloranyl-3-methanoyl-phenyl] benzoate Openeye Name: [2-(2-amino-1-chloro-2-oxo-ethyl)sulfanyl-5-chloro-3-formyl-phenyl] benzoate CAS Name: benzoic acid [2-[(2-amino-1-chloro-2-oxoethyl)thio]-5-chloro-3-formylphenyl] ester IUPAC Name: [2-(2-amino-1-chloro-2-oxoethyl)sulfanyl-5-chloro-3-formylphenyl] benzoate Traditional Name: benzoic acid [2-[(2-amino-1-chloro-2-keto-ethyl)thio]-5-chloro-3-formyl-phenyl] ester Formula: C16H11Cl2NO4S MolecularWeight: 384.23384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(C(=CC(=C2)Cl)C=O)SC(C(=O)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(C(=CC(=C2)Cl)C=O)SC(C(=O)N)Cl

InChI

InChI=1S/C16H11Cl2NO4S/c17-11-6-10(8-20)13(24-14(18)15(19)21)12(7-11)23-16(22)9-4-2-1-3-5-9/h1-8,14H,(H2,19,21)