4-methyl-N-(2-pentanoylphenyl)benzenesulfonamide

Systemtic Name: 4-methyl-N-(2-pentanoylphenyl)benzenesulfonamide Openeye Name: 4-methyl-N-(2-pentanoylphenyl)benzenesulfonamide CAS Name: 4-methyl-N-[2-(1-oxopentyl)phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-(2-pentanoylphenyl)benzenesulfonamide Traditional Name: 4-methyl-N-(2-valerylphenyl)benzenesulfonamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H21NO3S/c1-3-4-9-18(20)16-7-5-6-8-17(16)19-23(21,22)15-12-10-14(2)11-13-15/h5-8,10-13,19H,3-4,9H2,1-2H3