ethyl (2S,3R)-2-[(4-methoxyphenyl)amino]-3,5-bis(oxidanyl)-4-oxidanylidene-pentanoate

Systemtic Name: ethyl (2S,3R)-2-[(4-methoxyphenyl)amino]-3,5-bis(oxidanyl)-4-oxidanylidene-pentanoate Openeye Name: ethyl (2S,3R)-3,5-dihydroxy-2-(4-methoxyanilino)-4-oxo-pentanoate CAS Name: (2S,3R)-3,5-dihydroxy-2-(4-methoxyanilino)-4-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3,5-dihydroxy-2-(4-methoxyanilino)-4-oxopentanoate Traditional Name: (2S,3R)-3,5-dihydroxy-4-keto-2-(p-anisidino)valeric acid ethyl ester Formula: C14H19NO6 MolecularWeight: 297.30376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)CO)O)NC1=CC=C(C=C1)OC

Isomeric SMILES

CCOC(=O)[C@H]([C@H](C(=O)CO)O)NC1=CC=C(C=C1)OC

InChI

InChI=1S/C14H19NO6/c1-3-21-14(19)12(13(18)11(17)8-16)15-9-4-6-10(20-2)7-5-9/h4-7,12-13,15-16,18H,3,8H2,1-2H3/t12-,13-/m0/s1