3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-2-(phenylmethyl)butanoate

Systemtic Name: 3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-2-(phenylmethyl)butanoate Openeye Name: 2-benzyl-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]butanoate CAS Name: 3-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]-2-(phenylmethyl)butanoate IUPAC Name: 2-benzyl-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]butanoate Traditional Name: 2-benzyl-3-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]butyrate Formula: C25H28ClN2O2- MolecularWeight: 423.95502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C(C)C(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C(C)C(CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C25H29ClN2O2/c1-3-4-14-24-27-16-23(28(24)17-20-12-8-9-13-22(20)26)18(2)21(25(29)30)15-19-10-6-5-7-11-19/h5-13,16,18,21H,3-4,14-15,17H2,1-2H3,(H,29,30)/p-1