2-butyl-5-chloranyl-1-[5-(2-cyanophenyl)-2,3-dihydro-1H-inden-1-yl]imidazole-4-carboxylic acid

Systemtic Name: 2-butyl-5-chloranyl-1-[5-(2-cyanophenyl)-2,3-dihydro-1H-inden-1-yl]imidazole-4-carboxylic acid Openeye Name: 2-butyl-5-chloro-1-[5-(2-cyanophenyl)indan-1-yl]imidazole-4-carboxylic acid CAS Name: 2-butyl-5-chloro-1-[5-(2-cyanophenyl)-2,3-dihydro-1H-inden-1-yl]-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-5-chloro-1-[5-(2-cyanophenyl)-2,3-dihydro-1H-inden-1-yl]imidazole-4-carboxylic acid Traditional Name: 2-butyl-5-chloro-1-[5-(2-cyanophenyl)indan-1-yl]imidazole-4-carboxylic acid Formula: C24H22ClN3O2 MolecularWeight: 419.90338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1C2CCC3=C2C=CC(=C3)C4=CC=CC=C4C#N)Cl)C(=O)O

Isomeric SMILES

CCCCC1=NC(=C(N1C2CCC3=C2C=CC(=C3)C4=CC=CC=C4C#N)Cl)C(=O)O

InChI

InChI=1S/C24H22ClN3O2/c1-2-3-8-21-27-22(24(29)30)23(25)28(21)20-12-10-16-13-15(9-11-19(16)20)18-7-5-4-6-17(18)14-26/h4-7,9,11,13,20H,2-3,8,10,12H2,1H3,(H,29,30)