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

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]propanoic acid Openeye Name: 2-[4-[(3-chlorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoic acid CAS Name: 2-[4-[(3-chlorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoic acid IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoic acid Traditional Name: 2-[4-(3-chlorobenzyl)-3-keto-1,4-benzothiazin-2-yl]propionic acid Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)N(C2=CC=CC=C2S1)CC3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC(C1C(=O)N(C2=CC=CC=C2S1)CC3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C18H16ClNO3S/c1-11(18(22)23)16-17(21)20(10-12-5-4-6-13(19)9-12)14-7-2-3-8-15(14)24-16/h2-9,11,16H,10H2,1H3,(H,22,23)