(4-nitrophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoate

Systemtic Name: (4-nitrophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoate Openeye Name: (4-nitrophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoate Traditional Name: 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoic acid (4-nitrobenzyl) ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O6S/c1-3-4-5-19-7-11-21(12-8-19)26-34(31,32)23-15-6-18(2)24(16-23)25(28)33-17-20-9-13-22(14-10-20)27(29)30/h6-16,26H,3-5,17H2,1-2H3