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

Systemtic Name: 3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-4-chloranyl-benzoate Openeye Name: 3-[5-(1,3-benzothiazol-2-yl)-2-furyl]-4-chloro-benzoate CAS Name: 3-[5-(1,3-benzothiazol-2-yl)-2-furanyl]-4-chlorobenzoate IUPAC Name: 3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-4-chlorobenzoate Traditional Name: 3-[5-(1,3-benzothiazol-2-yl)-2-furyl]-4-chloro-benzoate Formula: C18H9ClNO3S- MolecularWeight: 354.78696

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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)/p-1