[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl] (2R,3S)-3-methyl-2-phenyl-pentanoate

Systemtic Name: [2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl] (2R,3S)-3-methyl-2-phenyl-pentanoate Openeye Name: [2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] (2R,3S)-3-methyl-2-phenyl-pentanoate CAS Name: (2R,3S)-3-methyl-2-phenylpentanoic acid [2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] (2R,3S)-3-methyl-2-phenylpentanoate Traditional Name: (2R,3S)-3-methyl-2-phenyl-valeric acid [2-keto-2-[[(1S)-1-phenylethyl]amino]ethyl] ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)OCC(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO3/c1-4-16(2)21(19-13-9-6-10-14-19)22(25)26-15-20(24)23-17(3)18-11-7-5-8-12-18/h5-14,16-17,21H,4,15H2,1-3H3,(H,23,24)/t16-,17-,21+/m0/s1