2-phenoxy-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoic acid

Systemtic Name: 2-phenoxy-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoic acid Openeye Name: 2-phenoxy-2-(3-pyridylmethylcarbamoyl)but-3-enoic acid CAS Name: 2-[oxo-(3-pyridinylmethylamino)methyl]-2-phenoxy-3-butenoic acid IUPAC Name: 2-phenoxy-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoic acid Traditional Name: 2-phenoxy-2-(3-pyridylmethylcarbamoyl)but-3-enoic acid Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O4/c1-2-17(16(21)22,23-14-8-4-3-5-9-14)15(20)19-12-13-7-6-10-18-11-13/h2-11H,1,12H2,(H,19,20)(H,21,22)