methyl 4-(4-pyridin-3-ylimidazol-1-yl)butanoate

Systemtic Name: methyl 4-(4-pyridin-3-ylimidazol-1-yl)butanoate Openeye Name: methyl 4-[4-(3-pyridyl)imidazol-1-yl]butanoate CAS Name: 4-[4-(3-pyridinyl)-1-imidazolyl]butanoic acid methyl ester IUPAC Name: methyl 4-(4-pyridin-3-ylimidazol-1-yl)butanoate Traditional Name: 4-[4-(3-pyridyl)imidazol-1-yl]butyric acid methyl ester Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C=C(N=C1)C2=CN=CC=C2

Isomeric SMILES

COC(=O)CCCN1C=C(N=C1)C2=CN=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-18-13(17)5-3-7-16-9-12(15-10-16)11-4-2-6-14-8-11/h2,4,6,8-10H,3,5,7H2,1H3