[3-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3-oxidanylidene-propyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [3-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3-oxidanylidene-propyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: [3-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3-oxo-propyl] (2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid [3-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3-oxopropyl] ester IUPAC Name: [3-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3-oxopropyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-methyl-butyric acid (3-keto-2,2-dimethyl-3-p-anisyloxy-propyl) ester Formula: C26H33NO7 MolecularWeight: 471.54272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(C)(C)C(=O)OCC1=CC=C(C=C1)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(C)(C)C(=O)OCC1=CC=C(C=C1)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H33NO7/c1-18(2)22(27-25(30)33-16-19-9-7-6-8-10-19)23(28)34-17-26(3,4)24(29)32-15-20-11-13-21(31-5)14-12-20/h6-14,18,22H,15-17H2,1-5H3,(H,27,30)/t22-/m0/s1