4-methoxy-3-[[2-(phenylmethyl)phenyl]sulfamoyl]benzoate

Systemtic Name: 4-methoxy-3-[[2-(phenylmethyl)phenyl]sulfamoyl]benzoate Openeye Name: 3-[(2-benzylphenyl)sulfamoyl]-4-methoxy-benzoate CAS Name: 4-methoxy-3-[[2-(phenylmethyl)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[(2-benzylphenyl)sulfamoyl]-4-methoxybenzoate Traditional Name: 3-[(2-benzylphenyl)sulfamoyl]-4-methoxy-benzoate Formula: C21H18NO5S- MolecularWeight: 396.43632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NC2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NC2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C21H19NO5S/c1-27-19-12-11-17(21(23)24)14-20(19)28(25,26)22-18-10-6-5-9-16(18)13-15-7-3-2-4-8-15/h2-12,14,22H,13H2,1H3,(H,23,24)/p-1