3-[[3-(1,3-benzothiazol-2-ylmethoxy)phenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[3-(1,3-benzothiazol-2-ylmethoxy)phenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-(1,3-benzothiazol-2-ylmethoxy)anilino]-3-oxo-propanoic acid CAS Name: 3-[3-(1,3-benzothiazol-2-ylmethoxy)anilino]-3-oxopropanoic acid IUPAC Name: 3-[3-(1,3-benzothiazol-2-ylmethoxy)anilino]-3-oxopropanoic acid Traditional Name: 3-[3-(1,3-benzothiazol-2-ylmethoxy)anilino]-3-keto-propionic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC3=CC=CC(=C3)NC(=O)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC3=CC=CC(=C3)NC(=O)CC(=O)O

InChI

InChI=1S/C17H14N2O4S/c20-15(9-17(21)22)18-11-4-3-5-12(8-11)23-10-16-19-13-6-1-2-7-14(13)24-16/h1-8H,9-10H2,(H,18,20)(H,21,22)