(phenylmethyl) (2S)-4-methyl-2-[[(2R)-1-morpholin-4-yl-1-oxidanylidene-4-phenyl-butan-2-yl]amino]pentanoate

Systemtic Name: (phenylmethyl) (2S)-4-methyl-2-[[(2R)-1-morpholin-4-yl-1-oxidanylidene-4-phenyl-butan-2-yl]amino]pentanoate Openeye Name: benzyl (2S)-4-methyl-2-[[(1R)-1-(morpholine-4-carbonyl)-3-phenyl-propyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[(2R)-1-(4-morpholinyl)-1-oxo-4-phenylbutan-2-yl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-4-methyl-2-[[(2R)-1-morpholin-4-yl-1-oxo-4-phenylbutan-2-yl]amino]pentanoate Traditional Name: (2S)-4-methyl-2-[[(1R)-1-(morpholine-4-carbonyl)-3-phenyl-propyl]amino]valeric acid benzyl ester Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(CCC2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)N[C@H](CCC2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C27H36N2O4/c1-21(2)19-25(27(31)33-20-23-11-7-4-8-12-23)28-24(14-13-22-9-5-3-6-10-22)26(30)29-15-17-32-18-16-29/h3-12,21,24-25,28H,13-20H2,1-2H3/t24-,25+/m1/s1