5-oxidanylidene-5-(pyridin-3-ylmethylamino)pent-3-enoic acid

Systemtic Name: 5-oxidanylidene-5-(pyridin-3-ylmethylamino)pent-3-enoic acid Openeye Name: 5-oxo-5-(3-pyridylmethylamino)pent-3-enoic acid CAS Name: 5-oxo-5-(3-pyridinylmethylamino)-3-pentenoic acid IUPAC Name: 5-oxo-5-(pyridin-3-ylmethylamino)pent-3-enoic acid Traditional Name: 5-keto-5-(3-pyridylmethylamino)pent-3-enoic acid Formula: C11H12N2O3 MolecularWeight: 220.22458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)C=CCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)C=CCC(=O)O

InChI

InChI=1S/C11H12N2O3/c14-10(4-1-5-11(15)16)13-8-9-3-2-6-12-7-9/h1-4,6-7H,5,8H2,(H,13,14)(H,15,16)