(5-methyl-2-propan-2-yl-phenyl) (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (2-isopropyl-5-methyl-phenyl) (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H29NO4/c1-19(2)23-15-14-20(3)16-25(23)32-26(29)24(17-21-10-6-4-7-11-21)28-27(30)31-18-22-12-8-5-9-13-22/h4-16,19,24H,17-18H2,1-3H3,(H,28,30)/t24-/m0/s1