3-[(2,4-dichlorophenyl)methoxy]-4-(1-imidazol-1-ylbutyl)benzoic acid

Systemtic Name: 3-[(2,4-dichlorophenyl)methoxy]-4-(1-imidazol-1-ylbutyl)benzoic acid Openeye Name: 3-[(2,4-dichlorophenyl)methoxy]-4-(1-imidazol-1-ylbutyl)benzoic acid CAS Name: 3-[(2,4-dichlorophenyl)methoxy]-4-[1-(1-imidazolyl)butyl]benzoic acid IUPAC Name: 3-[(2,4-dichlorophenyl)methoxy]-4-(1-imidazol-1-ylbutyl)benzoic acid Traditional Name: 3-(2,4-dichlorobenzyl)oxy-4-(1-imidazol-1-ylbutyl)benzoic acid Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)C(=O)O)OCC2=C(C=C(C=C2)Cl)Cl)N3C=CN=C3

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)C(=O)O)OCC2=C(C=C(C=C2)Cl)Cl)N3C=CN=C3

InChI

InChI=1S/C21H20Cl2N2O3/c1-2-3-19(25-9-8-24-13-25)17-7-5-14(21(26)27)10-20(17)28-12-15-4-6-16(22)11-18(15)23/h4-11,13,19H,2-3,12H2,1H3,(H,26,27)