(E)-3-azanyl-2-[4,5-bis(phenylmethoxy)pyridin-2-yl]oxycarbonyl-prop-2-enoic acid

Systemtic Name: (E)-3-azanyl-2-[4,5-bis(phenylmethoxy)pyridin-2-yl]oxycarbonyl-prop-2-enoic acid Openeye Name: (E)-3-amino-2-[(4,5-dibenzyloxy-2-pyridyl)oxycarbonyl]prop-2-enoic acid CAS Name: (E)-3-amino-2-[[4,5-bis(phenylmethoxy)-2-pyridinyl]oxy-oxomethyl]-2-propenoic acid IUPAC Name: (E)-3-amino-2-[4,5-bis(phenylmethoxy)pyridin-2-yl]oxycarbonylprop-2-enoic acid Traditional Name: (E)-3-amino-2-[(4,5-dibenzoxy-2-pyridyl)oxycarbonyl]acrylic acid Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=NC=C2OCC3=CC=CC=C3)OC(=O)C(=CN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=NC=C2OCC3=CC=CC=C3)OC(=O)/C(=C/N)/C(=O)O

InChI

InChI=1S/C23H20N2O6/c24-12-18(22(26)27)23(28)31-21-11-19(29-14-16-7-3-1-4-8-16)20(13-25-21)30-15-17-9-5-2-6-10-17/h1-13H,14-15,24H2,(H,26,27)/b18-12+