2-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]-9H-fluorene-9-carboxylic acid

Systemtic Name: 2-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]-9H-fluorene-9-carboxylic acid Openeye Name: 2-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]-9H-fluorene-9-carboxylic acid CAS Name: 2-[(2-butyl-4-chloro-5-formyl-1-imidazolyl)methyl]-9H-fluorene-9-carboxylic acid IUPAC Name: 2-[(2-butyl-4-chloro-5-formylimidazol-1-yl)methyl]-9H-fluorene-9-carboxylic acid Traditional Name: 2-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]-9H-fluorene-9-carboxylic acid Formula: C23H21ClN2O3 MolecularWeight: 408.87744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)C4=CC=CC=C4C3C(=O)O)C=O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)C4=CC=CC=C4C3C(=O)O)C=O)Cl

InChI

InChI=1S/C23H21ClN2O3/c1-2-3-8-20-25-22(24)19(13-27)26(20)12-14-9-10-16-15-6-4-5-7-17(15)21(23(28)29)18(16)11-14/h4-7,9-11,13,21H,2-3,8,12H2,1H3,(H,28,29)