3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid

Systemtic Name: 3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid Openeye Name: 3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid CAS Name: 3-[6-[1-(2-diethylaminoethyl)-4-imidazolyl]-2-ethyl-4-methyl-1-benzimidazolyl]-2-methyl-6-phenylbenzoic acid IUPAC Name: 3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methylbenzimidazol-1-yl]-2-methyl-6-phenylbenzoic acid Traditional Name: 3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid Formula: C33H37N5O2 MolecularWeight: 535.67918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)C(=O)O)C)C5=CN(C=N5)CCN(CC)CC)C

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)C(=O)O)C)C5=CN(C=N5)CCN(CC)CC)C

InChI

InChI=1S/C33H37N5O2/c1-6-30-35-32-22(4)18-25(27-20-37(21-34-27)17-16-36(7-2)8-3)19-29(32)38(30)28-15-14-26(24-12-10-9-11-13-24)31(23(28)5)33(39)40/h9-15,18-21H,6-8,16-17H2,1-5H3,(H,39,40)