(phenylmethyl) (2S)-4-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (phenylmethyl) (2S)-4-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: benzyl (2S)-2-(tert-butoxycarbonylamino)-4-(4-methoxyphenyl)butanoate CAS Name: (2S)-4-(4-methoxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-4-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-4-(4-methoxyphenyl)butyric acid benzyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=CC=C(C=C1)OC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC1=CC=C(C=C1)OC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29NO5/c1-23(2,3)29-22(26)24-20(15-12-17-10-13-19(27-4)14-11-17)21(25)28-16-18-8-6-5-7-9-18/h5-11,13-14,20H,12,15-16H2,1-4H3,(H,24,26)/t20-/m0/s1