4-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoic acid Openeye Name: 4-[[1-(imidazol-1-ylmethyl)-2-[(4-methoxyphenyl)methoxy]ethoxy]methyl]benzoic acid CAS Name: 4-[[1-(1-imidazolyl)-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoic acid IUPAC Name: 4-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoic acid Traditional Name: 4-[[1-(imidazol-1-ylmethyl)-2-p-anisyloxy-ethoxy]methyl]benzoic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COCC(CN2C=CN=C2)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)COCC(CN2C=CN=C2)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H24N2O5/c1-27-20-8-4-17(5-9-20)13-28-15-21(12-24-11-10-23-16-24)29-14-18-2-6-19(7-3-18)22(25)26/h2-11,16,21H,12-15H2,1H3,(H,25,26)