(phenylmethyl) (2S)-5-(4-methylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: (phenylmethyl) (2S)-5-(4-methylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: benzyl (2S)-2-(tert-butoxycarbonylamino)-5-(p-tolyl)pentanoate CAS Name: (2S)-5-(4-methylphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-5-(4-methylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-(p-tolyl)valeric acid benzyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO4/c1-18-13-15-19(16-14-18)11-8-12-21(25-23(27)29-24(2,3)4)22(26)28-17-20-9-6-5-7-10-20/h5-7,9-10,13-16,21H,8,11-12,17H2,1-4H3,(H,25,27)/t21-/m0/s1