(4-methoxycarbonylphenyl) 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzoate

Systemtic Name: (4-methoxycarbonylphenyl) 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzoate Openeye Name: (4-methoxycarbonylphenyl) 2-(2-amino-2-oxo-ethyl)sulfanylbenzoate CAS Name: 2-[(2-amino-2-oxoethyl)thio]benzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 2-(2-amino-2-oxoethyl)sulfanylbenzoate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]benzoic acid (4-carbomethoxyphenyl) ester Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SCC(=O)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SCC(=O)N

InChI

InChI=1S/C17H15NO5S/c1-22-16(20)11-6-8-12(9-7-11)23-17(21)13-4-2-3-5-14(13)24-10-15(18)19/h2-9H,10H2,1H3,(H2,18,19)