methyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-4-(4-phenylmethoxyphenyl)butanoate

Systemtic Name: methyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-4-(4-phenylmethoxyphenyl)butanoate Openeye Name: methyl (3S)-4-(4-benzyloxyphenyl)-3-(tert-butoxycarbonylamino)-2-oxo-butanoate CAS Name: (3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-4-(4-phenylmethoxyphenyl)butanoic acid methyl ester IUPAC Name: methyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-4-(4-phenylmethoxyphenyl)butanoate Traditional Name: (3S)-4-(4-benzoxyphenyl)-3-(tert-butoxycarbonylamino)-2-keto-butyric acid methyl ester Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO6/c1-23(2,3)30-22(27)24-19(20(25)21(26)28-4)14-16-10-12-18(13-11-16)29-15-17-8-6-5-7-9-17/h5-13,19H,14-15H2,1-4H3,(H,24,27)/t19-/m0/s1