2-[[3-butyl-4-(dimethoxymethyl)-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[3-butyl-4-(dimethoxymethyl)-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3-butyl-4-(dimethoxymethyl)-2-oxo-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[3-butyl-4-(dimethoxymethyl)-2-oxo-5-propyl-1-imidazolyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[3-butyl-4-(dimethoxymethyl)-2-oxo-5-propylimidazol-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3-butyl-4-(dimethoxymethyl)-2-keto-5-propyl-4-imidazolin-1-yl]methyl]-6-phenyl-benzoic acid Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCC)C(OC)OC

Isomeric SMILES

CCCCN1C(=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCC)C(OC)OC

InChI

InChI=1S/C27H34N2O5/c1-5-7-17-28-24(26(33-3)34-4)22(12-6-2)29(27(28)32)18-20-15-11-16-21(23(20)25(30)31)19-13-9-8-10-14-19/h8-11,13-16,26H,5-7,12,17-18H2,1-4H3,(H,30,31)