methyl 4-[1-[1-cyclohexyl-2-(cyclohexylamino)-2-oxidanylidene-ethyl]benzimidazol-2-yl]benzoate

Systemtic Name: methyl 4-[1-[1-cyclohexyl-2-(cyclohexylamino)-2-oxidanylidene-ethyl]benzimidazol-2-yl]benzoate Openeye Name: methyl 4-[1-[1-cyclohexyl-2-(cyclohexylamino)-2-oxo-ethyl]benzimidazol-2-yl]benzoate CAS Name: 4-[1-[1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]-2-benzimidazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-[1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]benzimidazol-2-yl]benzoate Traditional Name: 4-[1-[1-cyclohexyl-2-(cyclohexylamino)-2-keto-ethyl]benzimidazol-2-yl]benzoic acid methyl ester Formula: C29H35N3O3 MolecularWeight: 473.6065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2C(C4CCCCC4)C(=O)NC5CCCCC5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2C(C4CCCCC4)C(=O)NC5CCCCC5

InChI

InChI=1S/C29H35N3O3/c1-35-29(34)22-18-16-21(17-19-22)27-31-24-14-8-9-15-25(24)32(27)26(20-10-4-2-5-11-20)28(33)30-23-12-6-3-7-13-23/h8-9,14-20,23,26H,2-7,10-13H2,1H3,(H,30,33)