4-methylsulfonyl-N-[3-(2,3,5-trimethylphenoxy)propyl]benzamide

Systemtic Name: 4-methylsulfonyl-N-[3-(2,3,5-trimethylphenoxy)propyl]benzamide Openeye Name: 4-methylsulfonyl-N-[3-(2,3,5-trimethylphenoxy)propyl]benzamide CAS Name: 4-methylsulfonyl-N-[3-(2,3,5-trimethylphenoxy)propyl]benzamide IUPAC Name: 4-methylsulfonyl-N-[3-(2,3,5-trimethylphenoxy)propyl]benzamide Traditional Name: 4-mesyl-N-[3-(2,3,5-trimethylphenoxy)propyl]benzamide Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C)C

InChI

InChI=1S/C20H25NO4S/c1-14-12-15(2)16(3)19(13-14)25-11-5-10-21-20(22)17-6-8-18(9-7-17)26(4,23)24/h6-9,12-13H,5,10-11H2,1-4H3,(H,21,22)