(4-methoxy-4-oxidanylidene-butyl) (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (4-methoxy-4-oxidanylidene-butyl) (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (4-methoxy-4-oxo-butyl) (2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (4-methoxy-4-oxobutyl) ester IUPAC Name: (4-methoxy-4-oxobutyl) (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-methyl-butyric acid (4-keto-4-methoxy-butyl) ester Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCCCC(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)OCCCC(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H25NO6/c1-13(2)16(17(21)24-11-7-10-15(20)23-3)19-18(22)25-12-14-8-5-4-6-9-14/h4-6,8-9,13,16H,7,10-12H2,1-3H3,(H,19,22)/t16-/m0/s1