methyl (E,4R,5R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-6-phenyl-2-(phenylmethyl)hex-2-enoate

Systemtic Name: methyl (E,4R,5R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-6-phenyl-2-(phenylmethyl)hex-2-enoate Openeye Name: methyl (E,4R,5R)-2-benzyl-5-(tert-butoxycarbonylamino)-4-hydroxy-6-phenyl-hex-2-enoate CAS Name: (E,4R,5R)-4-hydroxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-phenyl-2-(phenylmethyl)-2-hexenoic acid methyl ester IUPAC Name: methyl (E,4R,5R)-2-benzyl-4-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenylhex-2-enoate Traditional Name: (E,4R,5R)-2-benzyl-5-(tert-butoxycarbonylamino)-4-hydroxy-6-phenyl-hex-2-enoic acid methyl ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(C=C(CC2=CC=CC=C2)C(=O)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)[C@@H](/C=C(\CC2=CC=CC=C2)/C(=O)OC)O

InChI

InChI=1S/C25H31NO5/c1-25(2,3)31-24(29)26-21(16-19-13-9-6-10-14-19)22(27)17-20(23(28)30-4)15-18-11-7-5-8-12-18/h5-14,17,21-22,27H,15-16H2,1-4H3,(H,26,29)/b20-17+/t21-,22-/m1/s1