methyl 2-phenoxy-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoate

Systemtic Name: methyl 2-phenoxy-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoate Openeye Name: methyl 2-phenoxy-2-(3-pyridylmethylcarbamoyl)but-3-enoate CAS Name: 2-[oxo-(3-pyridinylmethylamino)methyl]-2-phenoxy-3-butenoic acid methyl ester IUPAC Name: methyl 2-phenoxy-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoate Traditional Name: 2-phenoxy-2-(3-pyridylmethylcarbamoyl)but-3-enoic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C=C)(C(=O)NCC1=CN=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C=C)(C(=O)NCC1=CN=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O4/c1-3-18(17(22)23-2,24-15-9-5-4-6-10-15)16(21)20-13-14-8-7-11-19-12-14/h3-12H,1,13H2,2H3,(H,20,21)