ethyl (E)-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-6-phenylmethoxy-hex-3-enoate

Systemtic Name: ethyl (E)-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-6-phenylmethoxy-hex-3-enoate Openeye Name: ethyl (E)-6-benzyloxy-3-[4-(tert-butoxycarbonylamino)phenyl]hex-3-enoate CAS Name: (E)-3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-6-phenylmethoxy-3-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-6-phenylmethoxyhex-3-enoate Traditional Name: (E)-6-benzoxy-3-[4-(tert-butoxycarbonylamino)phenyl]hex-3-enoic acid ethyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=CCCOCC1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C/C(=C\CCOCC1=CC=CC=C1)/C2=CC=C(C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H33NO5/c1-5-31-24(28)18-22(12-9-17-30-19-20-10-7-6-8-11-20)21-13-15-23(16-14-21)27-25(29)32-26(2,3)4/h6-8,10-16H,5,9,17-19H2,1-4H3,(H,27,29)/b22-12+