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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC(C(=O)OCC)N(CC1=CC=CC=C1)[C@H](C2=CC=CC=C2)[C@H](C(=O)OCC)O

InChI

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