ethyl (2S,4R)-7,7-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-9-phenylmethoxy-nonanoate

Systemtic Name: ethyl (2S,4R)-7,7-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-9-phenylmethoxy-nonanoate Openeye Name: ethyl (2S,4R)-9-benzyloxy-2-(tert-butoxycarbonylamino)-4-hydroxy-7,7-dimethyl-nonanoate CAS Name: (2S,4R)-4-hydroxy-7,7-dimethyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-9-phenylmethoxynonanoic acid ethyl ester IUPAC Name: ethyl (2S,4R)-4-hydroxy-7,7-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-9-phenylmethoxynonanoate Traditional Name: (2S,4R)-9-benzoxy-2-(tert-butoxycarbonylamino)-4-hydroxy-7,7-dimethyl-pelargonic acid ethyl ester Formula: C25H41NO6 MolecularWeight: 451.59614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(CCC(C)(C)CCOCC1=CC=CC=C1)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](C[C@@H](CCC(C)(C)CCOCC1=CC=CC=C1)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H41NO6/c1-7-31-22(28)21(26-23(29)32-24(2,3)4)17-20(27)13-14-25(5,6)15-16-30-18-19-11-9-8-10-12-19/h8-12,20-21,27H,7,13-18H2,1-6H3,(H,26,29)/t20-,21+/m1/s1