methyl 3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]benzoate

Systemtic Name: methyl 3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]benzoate Openeye Name: methyl 3-[(1,1-dioxothian-4-yl)amino]benzoate CAS Name: 3-[(1,1-dioxo-4-thianyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(1,1-dioxothian-4-yl)amino]benzoate Traditional Name: 3-[(1,1-diketothian-4-yl)amino]benzoic acid methyl ester Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2CCS(=O)(=O)CC2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2CCS(=O)(=O)CC2

InChI

InChI=1S/C13H17NO4S/c1-18-13(15)10-3-2-4-12(9-10)14-11-5-7-19(16,17)8-6-11/h2-4,9,11,14H,5-8H2,1H3