O1-ethyl O3-methyl (2S)-2-[4-[methyl(phenyl)amino]phenyl]-2-oxidanyl-propanedioate

Systemtic Name: O1-ethyl O3-methyl (2S)-2-[4-[methyl(phenyl)amino]phenyl]-2-oxidanyl-propanedioate Openeye Name: O1-ethyl O3-methyl (2S)-2-hydroxy-2-[4-(N-methylanilino)phenyl]propanedioate CAS Name: (2S)-2-hydroxy-2-[4-(N-methylanilino)phenyl]propanedioic acid O1-ethyl ester O3-methyl ester IUPAC Name: 1-O-ethyl 3-O-methyl (2S)-2-hydroxy-2-[4-(N-methylanilino)phenyl]propanedioate Traditional Name: (2S)-2-hydroxy-2-[4-(N-methylanilino)phenyl]malonic acid O1-ethyl ester O3-methyl ester Formula: C19H21NO5 MolecularWeight: 343.37374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)N(C)C2=CC=CC=C2)(C(=O)OC)O

Isomeric SMILES

CCOC(=O)[C@](C1=CC=C(C=C1)N(C)C2=CC=CC=C2)(C(=O)OC)O

InChI

InChI=1S/C19H21NO5/c1-4-25-18(22)19(23,17(21)24-3)14-10-12-16(13-11-14)20(2)15-8-6-5-7-9-15/h5-13,23H,4H2,1-3H3/t19-/m0/s1