(E)-4-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(6-morpholino-3-pyridyl)methylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[6-(4-morpholinyl)-3-pyridinyl]methylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[(6-morpholino-3-pyridyl)methylamino]but-2-enoic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)CNC(=O)C=CC(=O)O

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)CNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C14H17N3O4/c18-13(3-4-14(19)20)16-10-11-1-2-12(15-9-11)17-5-7-21-8-6-17/h1-4,9H,5-8,10H2,(H,16,18)(H,19,20)/b4-3+