(E)-4-(2,4-dimethyl-3-phosphono-pentan-3-yl)-2-formamido-10-(phenylmethoxycarbonylamino)dec-3-enoic acid

Systemtic Name: (E)-4-(2,4-dimethyl-3-phosphono-pentan-3-yl)-2-formamido-10-(phenylmethoxycarbonylamino)dec-3-enoic acid Openeye Name: (E)-10-(benzyloxycarbonylamino)-2-formamido-4-(1-isopropyl-2-methyl-1-phosphono-propyl)dec-3-enoic acid CAS Name: (E)-4-(2,4-dimethyl-3-phosphonopentan-3-yl)-2-formamido-10-(phenylmethoxycarbonylamino)-3-decenoic acid IUPAC Name: (E)-4-(2,4-dimethyl-3-phosphonopentan-3-yl)-2-formamido-10-(phenylmethoxycarbonylamino)dec-3-enoic acid Traditional Name: (E)-10-(benzyloxycarbonylamino)-2-formamido-4-(1-isopropyl-2-methyl-1-phosphono-propyl)dec-3-enoic acid Formula: C26H41N2O8P MolecularWeight: 540.586101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)(C(=CC(C(=O)O)NC=O)CCCCCCNC(=O)OCC1=CC=CC=C1)P(=O)(O)O

Isomeric SMILES

CC(C)C(C(C)C)(/C(=C/C(C(=O)O)NC=O)/CCCCCCNC(=O)OCC1=CC=CC=C1)P(=O)(O)O

InChI

InChI=1S/C26H41N2O8P/c1-19(2)26(20(3)4,37(33,34)35)22(16-23(24(30)31)28-18-29)14-10-5-6-11-15-27-25(32)36-17-21-12-8-7-9-13-21/h7-9,12-13,16,18-20,23H,5-6,10-11,14-15,17H2,1-4H3,(H,27,32)(H,28,29)(H,30,31)(H2,33,34,35)/b22-16+