4-cyano-4-(6-imidazol-1-ylpyridin-3-yl)-4-morpholin-4-yl-butanoate

Systemtic Name: 4-cyano-4-(6-imidazol-1-ylpyridin-3-yl)-4-morpholin-4-yl-butanoate Openeye Name: 4-cyano-4-(6-imidazol-1-yl-3-pyridyl)-4-morpholino-butanoate CAS Name: 4-cyano-4-[6-(1-imidazolyl)-3-pyridinyl]-4-(4-morpholinyl)butanoate IUPAC Name: 4-cyano-4-(6-imidazol-1-ylpyridin-3-yl)-4-morpholin-4-ylbutanoate Traditional Name: 4-cyano-4-(6-imidazol-1-yl-3-pyridyl)-4-morpholino-butyrate Formula: C17H18N5O3- MolecularWeight: 340.35652

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CCC(=O)[O-])(C#N)C2=CN=C(C=C2)N3C=CN=C3

Isomeric SMILES

C1COCCN1C(CCC(=O)[O-])(C#N)C2=CN=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C17H19N5O3/c18-12-17(4-3-16(23)24,22-7-9-25-10-8-22)14-1-2-15(20-11-14)21-6-5-19-13-21/h1-2,5-6,11,13H,3-4,7-10H2,(H,23,24)/p-1