3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-4-chloranyl-benzoic acid

Systemtic Name: 3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-4-chloranyl-benzoic acid Openeye Name: 3-[5-(1,3-benzothiazol-2-yl)-2-furyl]-4-chloro-benzoic acid CAS Name: 3-[5-(1,3-benzothiazol-2-yl)-2-furanyl]-4-chlorobenzoic acid IUPAC Name: 3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-4-chlorobenzoic acid Traditional Name: 3-[5-(1,3-benzothiazol-2-yl)-2-furyl]-4-chloro-benzoic acid Formula: C18H10ClNO3S MolecularWeight: 355.7949

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)Cl

InChI

InChI=1S/C18H10ClNO3S/c19-12-6-5-10(18(21)22)9-11(12)14-7-8-15(23-14)17-20-13-3-1-2-4-16(13)24-17/h1-9H,(H,21,22)