pyridin-2-ylmethyl 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: pyridin-2-ylmethyl 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: 2-pyridylmethyl 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid 2-pyridylmethyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CC=N3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C23H24N2O4S/c1-2-3-7-18-11-13-20(14-12-18)25-30(27,28)22-10-6-8-19(16-22)23(26)29-17-21-9-4-5-15-24-21/h4-6,8-16,25H,2-3,7,17H2,1H3