2-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]propanoic acid

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]propanoic acid Openeye Name: 2-[3-oxo-4-(p-tolylmethyl)-1,4-benzothiazin-2-yl]propanoic acid CAS Name: 2-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoic acid IUPAC Name: 2-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoic acid Traditional Name: 2-[3-keto-4-(4-methylbenzyl)-1,4-benzothiazin-2-yl]propionic acid Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=CC=CC=C3SC(C2=O)C(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=CC=CC=C3SC(C2=O)C(C)C(=O)O

InChI

InChI=1S/C19H19NO3S/c1-12-7-9-14(10-8-12)11-20-15-5-3-4-6-16(15)24-17(18(20)21)13(2)19(22)23/h3-10,13,17H,11H2,1-2H3,(H,22,23)