3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxidanylidene-propanoate

Systemtic Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxidanylidene-propanoate Openeye Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxo-propanoate CAS Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxopropanoate IUPAC Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxopropanoate Traditional Name: 3-keto-3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)propionate Formula: C12H12NO3S- MolecularWeight: 250.29358

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCSC2=C1C=C(C=C2)C(=O)CC(=O)[O-]

Isomeric SMILES

CN1CCSC2=C1C=C(C=C2)C(=O)CC(=O)[O-]

InChI

InChI=1S/C12H13NO3S/c1-13-4-5-17-11-3-2-8(6-9(11)13)10(14)7-12(15)16/h2-3,6H,4-5,7H2,1H3,(H,15,16)/p-1