methyl 2-[6-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]quinolin-2-yl]benzoate

Systemtic Name: methyl 2-[6-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]quinolin-2-yl]benzoate Openeye Name: methyl 2-[6-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]-2-quinolyl]benzoate CAS Name: 2-[6-[(2-butyl-4-chloro-5-formyl-1-imidazolyl)methyl]-2-quinolinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[6-[(2-butyl-4-chloro-5-formylimidazol-1-yl)methyl]quinolin-2-yl]benzoate Traditional Name: 2-[6-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]-2-quinolyl]benzoic acid methyl ester Formula: C26H24ClN3O3 MolecularWeight: 461.94006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)N=C(C=C3)C4=CC=CC=C4C(=O)OC)C=O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)N=C(C=C3)C4=CC=CC=C4C(=O)OC)C=O)Cl

InChI

InChI=1S/C26H24ClN3O3/c1-3-4-9-24-29-25(27)23(16-31)30(24)15-17-10-12-21-18(14-17)11-13-22(28-21)19-7-5-6-8-20(19)26(32)33-2/h5-8,10-14,16H,3-4,9,15H2,1-2H3