3-chloranyl-2-[[3-[1-(phenylmethyl)pyrazol-4-yl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-chloranyl-2-[[3-[1-(phenylmethyl)pyrazol-4-yl]phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[3-(1-benzylpyrazol-4-yl)phenyl]sulfonylamino]-3-chloro-benzoic acid CAS Name: 3-chloro-2-[[3-[1-(phenylmethyl)-4-pyrazolyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[3-(1-benzylpyrazol-4-yl)phenyl]sulfonylamino]-3-chlorobenzoic acid Traditional Name: 2-[[3-(1-benzylpyrazol-4-yl)phenyl]sulfonylamino]-3-chloro-benzoic acid Formula: C23H18ClN3O4S MolecularWeight: 467.92472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C3=CC(=CC=C3)S(=O)(=O)NC4=C(C=CC=C4Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C3=CC(=CC=C3)S(=O)(=O)NC4=C(C=CC=C4Cl)C(=O)O

InChI

InChI=1S/C23H18ClN3O4S/c24-21-11-5-10-20(23(28)29)22(21)26-32(30,31)19-9-4-8-17(12-19)18-13-25-27(15-18)14-16-6-2-1-3-7-16/h1-13,15,26H,14H2,(H,28,29)