4-chloranyl-3-[(4-methoxyphenyl)-(phenylmethyl)sulfamoyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[(4-methoxyphenyl)-(phenylmethyl)sulfamoyl]benzoic acid Openeye Name: 3-[benzyl-(4-methoxyphenyl)sulfamoyl]-4-chloro-benzoic acid CAS Name: 4-chloro-3-[(4-methoxyphenyl)-(phenylmethyl)sulfamoyl]benzoic acid IUPAC Name: 3-[benzyl-(4-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid Traditional Name: 3-[benzyl-(4-methoxyphenyl)sulfamoyl]-4-chloro-benzoic acid Formula: C21H18ClNO5S MolecularWeight: 431.88932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C21H18ClNO5S/c1-28-18-10-8-17(9-11-18)23(14-15-5-3-2-4-6-15)29(26,27)20-13-16(21(24)25)7-12-19(20)22/h2-13H,14H2,1H3,(H,24,25)