ethyl 2-[[(1R,2R)-3-ethoxy-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-(phenylmethyl)amino]-3-methyl-butanoate

Systemtic Name: ethyl 2-[[(1R,2R)-3-ethoxy-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-(phenylmethyl)amino]-3-methyl-butanoate Openeye Name: ethyl 2-[benzyl-[(1R,2R)-3-ethoxy-2-hydroxy-3-oxo-1-phenyl-propyl]amino]-3-methyl-butanoate CAS Name: 2-[[(1R,2R)-3-ethoxy-2-hydroxy-3-oxo-1-phenylpropyl]-(phenylmethyl)amino]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-[(1R,2R)-3-ethoxy-2-hydroxy-3-oxo-1-phenylpropyl]amino]-3-methylbutanoate Traditional Name: 2-[benzyl-[(1R,2R)-3-ethoxy-2-hydroxy-3-keto-1-phenyl-propyl]amino]-3-methyl-butyric acid ethyl ester Formula: C25H33NO5 MolecularWeight: 427.53322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N(CC1=CC=CC=C1)C(C2=CC=CC=C2)C(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)C(C(C)C)C(=O)OCC)O

InChI

InChI=1S/C25H33NO5/c1-5-30-24(28)21(18(3)4)26(17-19-13-9-7-10-14-19)22(20-15-11-8-12-16-20)23(27)25(29)31-6-2/h7-16,18,21-23,27H,5-6,17H2,1-4H3/t21?,22-,23-/m1/s1