5-methyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-2-oxidanyl-4-(phenylmethoxycarbonylamino)-2-phosphorosooxy-hexanoic acid

Systemtic Name: 5-methyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-2-oxidanyl-4-(phenylmethoxycarbonylamino)-2-phosphorosooxy-hexanoic acid Openeye Name: 4-(benzyloxycarbonylamino)-3-[2-(tert-butoxycarbonylamino)ethyl]-2-hydroxy-5-methyl-2-phosphorosooxy-hexanoic acid CAS Name: 2-hydroxy-5-methyl-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-4-(phenylmethoxycarbonylamino)-2-phosphorosooxyhexanoic acid IUPAC Name: 2-hydroxy-5-methyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-(phenylmethoxycarbonylamino)-2-phosphorosooxyhexanoic acid Traditional Name: 4-(benzyloxycarbonylamino)-3-[2-(tert-butoxycarbonylamino)ethyl]-2-hydroxy-5-methyl-2-phosphorosooxy-hexanoic acid Formula: C22H33N2O9P MolecularWeight: 500.479181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(CCNC(=O)OC(C)(C)C)C(C(=O)O)(O)OP=O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(CCNC(=O)OC(C)(C)C)C(C(=O)O)(O)OP=O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C22H33N2O9P/c1-14(2)17(24-20(28)31-13-15-9-7-6-8-10-15)16(22(29,18(25)26)33-34-30)11-12-23-19(27)32-21(3,4)5/h6-10,14,16-17,29H,11-13H2,1-5H3,(H,23,27)(H,24,28)(H,25,26)