2-[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]ethanoylamino]-N-propyl-benzamide

Systemtic Name: 2-[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]ethanoylamino]-N-propyl-benzamide Openeye Name: 2-[[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]acetyl]amino]-N-propyl-benzamide CAS Name: 2-[[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-1-oxoethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]acetyl]amino]-N-propylbenzamide Traditional Name: 2-[[2-[1,3-benzodioxol-5-yl(mesyl)amino]acetyl]amino]-N-propyl-benzamide Formula: C20H23N3O6S MolecularWeight: 433.47812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C20H23N3O6S/c1-3-10-21-20(25)15-6-4-5-7-16(15)22-19(24)12-23(30(2,26)27)14-8-9-17-18(11-14)29-13-28-17/h4-9,11H,3,10,12-13H2,1-2H3,(H,21,25)(H,22,24)