(phenylmethyl) (2S,4R)-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pentanoate

Systemtic Name: (phenylmethyl) (2S,4R)-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pentanoate Openeye Name: benzyl (2S,4R)-4-(tert-butoxycarbonylamino)-2-methyl-5-phenyl-pentanoate CAS Name: (2S,4R)-2-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,4R)-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpentanoate Traditional Name: (2S,4R)-4-(tert-butoxycarbonylamino)-2-methyl-5-phenyl-valeric acid benzyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H31NO4/c1-18(22(26)28-17-20-13-9-6-10-14-20)15-21(16-19-11-7-5-8-12-19)25-23(27)29-24(2,3)4/h5-14,18,21H,15-17H2,1-4H3,(H,25,27)/t18-,21+/m0/s1