2-[2-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]benzoic acid Openeye Name: 2-[2-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]benzoic acid CAS Name: 2-[2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]benzoic acid Traditional Name: 2-[2-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]benzoic acid Formula: C22H16N2O4S MolecularWeight: 404.43844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3C4=CC=CC=C4C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H16N2O4S/c1-28-13-10-11-18-19(12-13)29-22(23-18)24-20(25)16-8-4-2-6-14(16)15-7-3-5-9-17(15)21(26)27/h2-12H,1H3,(H,26,27)(H,23,24,25)