3-(1H-imidazol-5-ylmethyl)-2-propoxy-benzoic acid

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-2-propoxy-benzoic acid Openeye Name: 3-(1H-imidazol-5-ylmethyl)-2-propoxy-benzoic acid CAS Name: 3-(1H-imidazol-5-ylmethyl)-2-propoxybenzoic acid IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-2-propoxybenzoic acid Traditional Name: 3-(1H-imidazol-5-ylmethyl)-2-propoxy-benzoic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1CC2=CN=CN2)C(=O)O

Isomeric SMILES

CCCOC1=C(C=CC=C1CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-2-6-19-13-10(7-11-8-15-9-16-11)4-3-5-12(13)14(17)18/h3-5,8-9H,2,6-7H2,1H3,(H,15,16)(H,17,18)