4-cyano-N-[1-(3,4-dipropoxyphenyl)ethyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[1-(3,4-dipropoxyphenyl)ethyl]benzenesulfonamide Openeye Name: 4-cyano-N-[1-(3,4-dipropoxyphenyl)ethyl]benzenesulfonamide CAS Name: 4-cyano-N-[1-(3,4-dipropoxyphenyl)ethyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[1-(3,4-dipropoxyphenyl)ethyl]benzenesulfonamide Traditional Name: 4-cyano-N-[1-(3,4-dipropoxyphenyl)ethyl]benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C)NS(=O)(=O)C2=CC=C(C=C2)C#N)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(C)NS(=O)(=O)C2=CC=C(C=C2)C#N)OCCC

InChI

InChI=1S/C21H26N2O4S/c1-4-12-26-20-11-8-18(14-21(20)27-13-5-2)16(3)23-28(24,25)19-9-6-17(15-22)7-10-19/h6-11,14,16,23H,4-5,12-13H2,1-3H3