4-[3-(1-methylimidazol-4-yl)propoxy]benzoic acid

Systemtic Name: 4-[3-(1-methylimidazol-4-yl)propoxy]benzoic acid Openeye Name: 4-[3-(1-methylimidazol-4-yl)propoxy]benzoic acid CAS Name: 4-[3-(1-methyl-4-imidazolyl)propoxy]benzoic acid IUPAC Name: 4-[3-(1-methylimidazol-4-yl)propoxy]benzoic acid Traditional Name: 4-[3-(1-methylimidazol-4-yl)propoxy]benzoic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CCCOC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C=C(N=C1)CCCOC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-16-9-12(15-10-16)3-2-8-19-13-6-4-11(5-7-13)14(17)18/h4-7,9-10H,2-3,8H2,1H3,(H,17,18)