4-[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]-3-methyl-1-phenyl-indole-2-carboxylic acid

Systemtic Name: 4-[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]-3-methyl-1-phenyl-indole-2-carboxylic acid Openeye Name: 4-[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]-3-methyl-1-phenyl-indole-2-carboxylic acid CAS Name: 4-[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]-3-methyl-1-phenyl-2-indolecarboxylic acid IUPAC Name: 4-[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]-3-methyl-1-phenylindole-2-carboxylic acid Traditional Name: 4-(2-butyl-4-chloro-5-methylol-imidazol-1-yl)-3-methyl-1-phenyl-indole-2-carboxylic acid Formula: C24H24ClN3O3 MolecularWeight: 437.91866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1C2=CC=CC3=C2C(=C(N3C4=CC=CC=C4)C(=O)O)C)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1C2=CC=CC3=C2C(=C(N3C4=CC=CC=C4)C(=O)O)C)CO)Cl

InChI

InChI=1S/C24H24ClN3O3/c1-3-4-13-20-26-23(25)19(14-29)28(20)18-12-8-11-17-21(18)15(2)22(24(30)31)27(17)16-9-6-5-7-10-16/h5-12,29H,3-4,13-14H2,1-2H3,(H,30,31)