(2-oxidanylidene-1,2-diphenyl-ethyl) 4-[(2,3-dimethoxyphenyl)methyl-methylsulfonyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 4-[(2,3-dimethoxyphenyl)methyl-methylsulfonyl-amino]-4-oxidanylidene-butanoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 4-[(2,3-dimethoxyphenyl)methyl-methylsulfonyl-amino]-4-oxo-butanoate CAS Name: 4-[(2,3-dimethoxyphenyl)methyl-methylsulfonylamino]-4-oxobutanoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 4-[(2,3-dimethoxyphenyl)methyl-methylsulfonylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[mesyl(o-veratryl)amino]butyric acid desyl ester Formula: C28H29NO8S MolecularWeight: 539.59676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(C(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(C(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C28H29NO8S/c1-35-23-16-10-15-22(27(23)36-2)19-29(38(3,33)34)24(30)17-18-25(31)37-28(21-13-8-5-9-14-21)26(32)20-11-6-4-7-12-20/h4-16,28H,17-19H2,1-3H3