2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]benzoic acid

Systemtic Name: 2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]benzoic acid Openeye Name: 2-[5-(1,3-benzothiazol-2-yl)-2-furyl]benzoic acid CAS Name: 2-[5-(1,3-benzothiazol-2-yl)-2-furanyl]benzoic acid IUPAC Name: 2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]benzoic acid Traditional Name: 2-[5-(1,3-benzothiazol-2-yl)-2-furyl]benzoic acid Formula: C18H11NO3S MolecularWeight: 321.34984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C3=NC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)C3=NC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C18H11NO3S/c20-18(21)12-6-2-1-5-11(12)14-9-10-15(22-14)17-19-13-7-3-4-8-16(13)23-17/h1-10H,(H,20,21)