(phenylmethyl) 2-[methyl(2-propan-2-ylsulfonylethyl)carbamoyl]oxy-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[methyl(2-propan-2-ylsulfonylethyl)carbamoyl]oxy-3-phenyl-propanoate Openeye Name: benzyl 2-[2-isopropylsulfonylethyl(methyl)carbamoyl]oxy-3-phenyl-propanoate CAS Name: 2-[[methyl(2-propan-2-ylsulfonylethyl)amino]-oxomethoxy]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[methyl(2-propan-2-ylsulfonylethyl)carbamoyl]oxy-3-phenylpropanoate Traditional Name: 2-[2-isopropylsulfonylethyl(methyl)carbamoyl]oxy-3-phenyl-propionic acid benzyl ester Formula: C23H29NO6S MolecularWeight: 447.54446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)CCN(C)C(=O)OC(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)CCN(C)C(=O)OC(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29NO6S/c1-18(2)31(27,28)15-14-24(3)23(26)30-21(16-19-10-6-4-7-11-19)22(25)29-17-20-12-8-5-9-13-20/h4-13,18,21H,14-17H2,1-3H3