(phenylmethyl) (2R)-2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) (2R)-2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: benzyl (2R)-2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2R)-2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2R)-2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-3-methyl-butyric acid benzyl ester Formula: C22H29NO5S MolecularWeight: 419.53436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC(C(C)C)C(=O)OCC2=CC=CC=C2)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N[C@H](C(C)C)C(=O)OCC2=CC=CC=C2)C)C)OC

InChI

InChI=1S/C22H29NO5S/c1-14(2)20(22(24)28-13-18-10-8-7-9-11-18)23-29(25,26)21-15(3)12-19(27-6)16(4)17(21)5/h7-12,14,20,23H,13H2,1-6H3/t20-/m1/s1