2-[(3,5-dibutyl-4-methyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[(3,5-dibutyl-4-methyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(3,5-dibutyl-4-methyl-2-oxo-imidazol-1-yl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[(3,5-dibutyl-4-methyl-2-oxo-1-imidazolyl)methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(3,5-dibutyl-4-methyl-2-oxoimidazol-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(3,5-dibutyl-2-keto-4-methyl-4-imidazolin-1-yl)methyl]-6-phenyl-benzoic acid Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCCC)C

Isomeric SMILES

CCCCC1=C(N(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCCC)C

InChI

InChI=1S/C26H32N2O3/c1-4-6-16-23-19(3)27(17-7-5-2)26(31)28(23)18-21-14-11-15-22(24(21)25(29)30)20-12-9-8-10-13-20/h8-15H,4-7,16-18H2,1-3H3,(H,29,30)