2-[(4-carboxyphenyl)methyl]-1-oxidanylidene-3,4-dihydro-1$l^{4},4-benzothiazin-2-olate

Systemtic Name: 2-[(4-carboxyphenyl)methyl]-1-oxidanylidene-3,4-dihydro-1$l^{4},4-benzothiazin-2-olate Openeye Name: 2-[(4-carboxyphenyl)methyl]-1-oxo-3,4-dihydro-1$l^{4},4-benzothiazin-2-olate CAS Name: 2-[(4-carboxyphenyl)methyl]-1-oxo-3,4-dihydro-1$l^{4},4-benzothiazin-2-olate IUPAC Name: 2-[(4-carboxyphenyl)methyl]-1-oxo-3,4-dihydro-1$l^{4},4-benzothiazin-2-olate Traditional Name: 2-(4-carboxybenzyl)-1-keto-3,4-dihydro-1$l^{4},4-benzothiazin-2-olate Formula: C16H14NO4S- MolecularWeight: 316.35166

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S(=O)C2=CC=CC=C2N1)(CC3=CC=C(C=C3)C(=O)O)[O-]

Isomeric SMILES

C1C(S(=O)C2=CC=CC=C2N1)(CC3=CC=C(C=C3)C(=O)O)[O-]

InChI

InChI=1S/C16H14NO4S/c18-15(19)12-7-5-11(6-8-12)9-16(20)10-17-13-3-1-2-4-14(13)22(16)21/h1-8,17H,9-10H2,(H,18,19)/q-1