N-[3-(3-methylphenoxy)propyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[3-(3-methylphenoxy)propyl]-4-methylsulfonyl-benzamide Openeye Name: N-[3-(3-methylphenoxy)propyl]-4-methylsulfonyl-benzamide CAS Name: N-[3-(3-methylphenoxy)propyl]-4-methylsulfonylbenzamide IUPAC Name: N-[3-(3-methylphenoxy)propyl]-4-methylsulfonylbenzamide Traditional Name: 4-mesyl-N-[3-(3-methylphenoxy)propyl]benzamide Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO4S/c1-14-5-3-6-16(13-14)23-12-4-11-19-18(20)15-7-9-17(10-8-15)24(2,21)22/h3,5-10,13H,4,11-12H2,1-2H3,(H,19,20)