2-[1,3-benzodioxol-5-yl(propan-2-yl)amino]-1-[3-(methylsulfonylmethyl)-4-phenylmethoxy-phenyl]ethanone

Systemtic Name: 2-[1,3-benzodioxol-5-yl(propan-2-yl)amino]-1-[3-(methylsulfonylmethyl)-4-phenylmethoxy-phenyl]ethanone Openeye Name: 2-[1,3-benzodioxol-5-yl(isopropyl)amino]-1-[4-benzyloxy-3-(methylsulfonylmethyl)phenyl]ethanone CAS Name: 2-[1,3-benzodioxol-5-yl(propan-2-yl)amino]-1-[3-(methylsulfonylmethyl)-4-phenylmethoxyphenyl]ethanone IUPAC Name: 2-[1,3-benzodioxol-5-yl(propan-2-yl)amino]-1-[3-(methylsulfonylmethyl)-4-phenylmethoxyphenyl]ethanone Traditional Name: 2-[1,3-benzodioxol-5-yl(isopropyl)amino]-1-[4-benzoxy-3-(mesylmethyl)phenyl]ethanone Formula: C27H29NO6S MolecularWeight: 495.58726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)CS(=O)(=O)C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)N(CC(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)CS(=O)(=O)C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H29NO6S/c1-19(2)28(23-10-12-26-27(14-23)34-18-33-26)15-24(29)21-9-11-25(22(13-21)17-35(3,30)31)32-16-20-7-5-4-6-8-20/h4-14,19H,15-18H2,1-3H3