O1-ethyl O4-methyl (2R,3R)-2-benzamido-3-(4-methoxyphenoxy)butanedioate

Systemtic Name: O1-ethyl O4-methyl (2R,3R)-2-benzamido-3-(4-methoxyphenoxy)butanedioate Openeye Name: O1-ethyl O4-methyl (2R,3R)-2-benzamido-3-(4-methoxyphenoxy)butanedioate CAS Name: (2R,3R)-2-benzamido-3-(4-methoxyphenoxy)butanedioic acid O1-ethyl ester O4-methyl ester IUPAC Name: 1-O-ethyl 4-O-methyl (2R,3R)-2-benzamido-3-(4-methoxyphenoxy)butanedioate Traditional Name: (2R,3R)-2-benzamido-3-(4-methoxyphenoxy)succinic acid O1-ethyl ester O4-methyl ester Formula: C21H23NO7 MolecularWeight: 401.40982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)OC)OC1=CC=C(C=C1)OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](C(=O)OC)OC1=CC=C(C=C1)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO7/c1-4-28-20(24)17(22-19(23)14-8-6-5-7-9-14)18(21(25)27-3)29-16-12-10-15(26-2)11-13-16/h5-13,17-18H,4H2,1-3H3,(H,22,23)/t17-,18-/m1/s1