2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]-2-naphthalen-1-yl-ethanoic acid

Systemtic Name: 2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]-2-naphthalen-1-yl-ethanoic acid Openeye Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]-2-(1-naphthyl)acetic acid CAS Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]methyl]phenoxy]-2-(1-naphthalenyl)acetic acid IUPAC Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]-2-naphthalen-1-ylacetic acid Traditional Name: 2-[4-[(2-butyl-4-chloro-5-methylol-imidazol-1-yl)methyl]phenoxy]-2-(1-naphthyl)acetic acid Formula: C27H27ClN2O4 MolecularWeight: 478.96728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)OC(C3=CC=CC4=CC=CC=C43)C(=O)O)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)OC(C3=CC=CC4=CC=CC=C43)C(=O)O)CO)Cl

InChI

InChI=1S/C27H27ClN2O4/c1-2-3-11-24-29-26(28)23(17-31)30(24)16-18-12-14-20(15-13-18)34-25(27(32)33)22-10-6-8-19-7-4-5-9-21(19)22/h4-10,12-15,25,31H,2-3,11,16-17H2,1H3,(H,32,33)