4-azanyl-N-[[4-(2,3,6-trimethylphenoxy)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[[4-(2,3,6-trimethylphenoxy)phenyl]methyl]benzenesulfonamide Openeye Name: 4-amino-N-[[4-(2,3,6-trimethylphenoxy)phenyl]methyl]benzenesulfonamide CAS Name: 4-amino-N-[[4-(2,3,6-trimethylphenoxy)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-amino-N-[[4-(2,3,6-trimethylphenoxy)phenyl]methyl]benzenesulfonamide Traditional Name: 4-amino-N-[4-(2,3,6-trimethylphenoxy)benzyl]benzenesulfonamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)N)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)N)C

InChI

InChI=1S/C22H24N2O3S/c1-15-4-5-16(2)22(17(15)3)27-20-10-6-18(7-11-20)14-24-28(25,26)21-12-8-19(23)9-13-21/h4-13,24H,14,23H2,1-3H3