(4-methoxycarbonylphenyl)methyl 3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoate Openeye Name: (4-methoxycarbonylphenyl)methyl 3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoic acid (4-carbomethoxybenzyl) ester Formula: C27H29NO6S MolecularWeight: 495.58726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C27H29NO6S/c1-4-5-6-20-10-15-24(16-11-20)28-35(31,32)25-17-23(12-7-19(25)2)27(30)34-18-21-8-13-22(14-9-21)26(29)33-3/h7-17,28H,4-6,18H2,1-3H3