N-[(2,3-dimethylphenyl)methyl]-4-pentyl-benzenesulfonamide

Systemtic Name: N-[(2,3-dimethylphenyl)methyl]-4-pentyl-benzenesulfonamide Openeye Name: N-[(2,3-dimethylphenyl)methyl]-4-pentyl-benzenesulfonamide CAS Name: N-[(2,3-dimethylphenyl)methyl]-4-pentylbenzenesulfonamide IUPAC Name: N-[(2,3-dimethylphenyl)methyl]-4-pentylbenzenesulfonamide Traditional Name: 4-amyl-N-(2,3-dimethylbenzyl)benzenesulfonamide Formula: C20H27NO2S MolecularWeight: 345.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC(=C2C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC(=C2C)C

InChI

InChI=1S/C20H27NO2S/c1-4-5-6-9-18-11-13-20(14-12-18)24(22,23)21-15-19-10-7-8-16(2)17(19)3/h7-8,10-14,21H,4-6,9,15H2,1-3H3