cyclooctyl 3-[(1-methylbenzimidazol-2-yl)carbonylamino]propanoate dihydrochloride

Systemtic Name: cyclooctyl 3-[(1-methylbenzimidazol-2-yl)carbonylamino]propanoate dihydrochloride Openeye Name: cyclooctyl 3-[(1-methylbenzimidazole-2-carbonyl)amino]propanoate dihydrochloride CAS Name: 3-[[(1-methyl-2-benzimidazolyl)-oxomethyl]amino]propanoic acid cyclooctyl ester dihydrochloride IUPAC Name: cyclooctyl 3-[(1-methylbenzimidazole-2-carbonyl)amino]propanoate dihydrochloride Traditional Name: 3-[(1-methylbenzimidazole-2-carbonyl)amino]propionic acid cyclooctyl ester dihydrochloride Formula: C20H29Cl2N3O3 MolecularWeight: 430.36856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)OC3CCCCCCC3.Cl.Cl

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)OC3CCCCCCC3.Cl.Cl

InChI

InChI=1S/C20H27N3O3.2ClH/c1-23-17-12-8-7-11-16(17)22-19(23)20(25)21-14-13-18(24)26-15-9-5-3-2-4-6-10-15;;/h7-8,11-12,15H,2-6,9-10,13-14H2,1H3,(H,21,25);2*1H