ethyl 2-[4-[[2-butyl-6-(cyclohexylcarbonylamino)-1-methyl-benzimidazol-4-yl]methyl]phenoxy]-2-phenyl-ethanoate

Systemtic Name: ethyl 2-[4-[[2-butyl-6-(cyclohexylcarbonylamino)-1-methyl-benzimidazol-4-yl]methyl]phenoxy]-2-phenyl-ethanoate Openeye Name: ethyl 2-[4-[[2-butyl-6-(cyclohexanecarbonylamino)-1-methyl-benzimidazol-4-yl]methyl]phenoxy]-2-phenyl-acetate CAS Name: 2-[4-[[2-butyl-6-[[cyclohexyl(oxo)methyl]amino]-1-methyl-4-benzimidazolyl]methyl]phenoxy]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[2-butyl-6-(cyclohexanecarbonylamino)-1-methylbenzimidazol-4-yl]methyl]phenoxy]-2-phenylacetate Traditional Name: 2-[4-[[2-butyl-6-(cyclohexanecarbonylamino)-1-methyl-benzimidazol-4-yl]methyl]phenoxy]-2-phenyl-acetic acid ethyl ester Formula: C36H43N3O4 MolecularWeight: 581.74432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C)C=C(C=C2CC3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)OCC)NC(=O)C5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1C)C=C(C=C2CC3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)OCC)NC(=O)C5CCCCC5

InChI

InChI=1S/C36H43N3O4/c1-4-6-17-32-38-33-28(23-29(24-31(33)39(32)3)37-35(40)27-15-11-8-12-16-27)22-25-18-20-30(21-19-25)43-34(36(41)42-5-2)26-13-9-7-10-14-26/h7,9-10,13-14,18-21,23-24,27,34H,4-6,8,11-12,15-17,22H2,1-3H3,(H,37,40)