(E)-4-[3-(diethylcarbamoyl)-1-methoxycarbonyl-2H-pyridin-2-yl]but-2-enoic acid

Systemtic Name: (E)-4-[3-(diethylcarbamoyl)-1-methoxycarbonyl-2H-pyridin-2-yl]but-2-enoic acid Openeye Name: (E)-4-[3-(diethylcarbamoyl)-1-methoxycarbonyl-2H-pyridin-2-yl]but-2-enoic acid CAS Name: (E)-4-[3-[diethylamino(oxo)methyl]-1-methoxycarbonyl-2H-pyridin-2-yl]-2-butenoic acid IUPAC Name: (E)-4-[3-(diethylcarbamoyl)-1-methoxycarbonyl-2H-pyridin-2-yl]but-2-enoic acid Traditional Name: (E)-4-[1-carbomethoxy-3-(diethylcarbamoyl)-2H-pyridin-2-yl]but-2-enoic acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CN(C1CC=CC(=O)O)C(=O)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CN(C1C/C=C/C(=O)O)C(=O)OC

InChI

InChI=1S/C16H22N2O5/c1-4-17(5-2)15(21)12-8-7-11-18(16(22)23-3)13(12)9-6-10-14(19)20/h6-8,10-11,13H,4-5,9H2,1-3H3,(H,19,20)/b10-6+