tert-butyl (3R,4S,5S)-3-methoxy-5-methyl-4-(phenylmethoxycarbonylamino)heptanoate

Systemtic Name: tert-butyl (3R,4S,5S)-3-methoxy-5-methyl-4-(phenylmethoxycarbonylamino)heptanoate Openeye Name: tert-butyl (3R,4S,5S)-4-(benzyloxycarbonylamino)-3-methoxy-5-methyl-heptanoate CAS Name: (3R,4S,5S)-3-methoxy-5-methyl-4-(phenylmethoxycarbonylamino)heptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R,4S,5S)-3-methoxy-5-methyl-4-(phenylmethoxycarbonylamino)heptanoate Traditional Name: (3R,4S,5S)-4-(benzyloxycarbonylamino)-3-methoxy-5-methyl-enanthic acid tert-butyl ester Formula: C21H33NO5 MolecularWeight: 379.49042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33NO5/c1-7-15(2)19(17(25-6)13-18(23)27-21(3,4)5)22-20(24)26-14-16-11-9-8-10-12-16/h8-12,15,17,19H,7,13-14H2,1-6H3,(H,22,24)/t15-,17+,19-/m0/s1