ethyl (2S,3R)-3-methanoyl-2-[(4-methoxyphenyl)amino]octanoate

Systemtic Name: ethyl (2S,3R)-3-methanoyl-2-[(4-methoxyphenyl)amino]octanoate Openeye Name: ethyl (2S,3R)-3-formyl-2-(4-methoxyanilino)octanoate CAS Name: (2S,3R)-3-formyl-2-(4-methoxyanilino)octanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-formyl-2-(4-methoxyanilino)octanoate Traditional Name: (2S,3R)-3-formyl-2-(p-anisidino)caprylic acid ethyl ester Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=O)C(C(=O)OCC)NC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCC[C@@H](C=O)[C@@H](C(=O)OCC)NC1=CC=C(C=C1)OC

InChI

InChI=1S/C18H27NO4/c1-4-6-7-8-14(13-20)17(18(21)23-5-2)19-15-9-11-16(22-3)12-10-15/h9-14,17,19H,4-8H2,1-3H3/t14-,17-/m0/s1