2-fluoranylethyl 3-methyl-3-[4-(5-methyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]pyrrolidine-1-carboxylate

Systemtic Name: 2-fluoranylethyl 3-methyl-3-[4-(5-methyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]pyrrolidine-1-carboxylate Openeye Name: 2-fluoroethyl 3-methyl-3-[4-(5-methyl-2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]pyrrolidine-1-carboxylate CAS Name: 3-methyl-3-[4-(5-methyl-2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-1-pyrrolidinecarboxylic acid 2-fluoroethyl ester IUPAC Name: 2-fluoroethyl 3-methyl-3-[4-(5-methyl-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]pyrrolidine-1-carboxylate Traditional Name: 3-[4-(2-keto-5-methyl-3H-benzimidazol-1-yl)piperidino]-3-methyl-pyrrolidine-1-carboxylic acid 2-fluoroethyl ester Formula: C21H29FN4O3 MolecularWeight: 404.478363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)N2)C3CCN(CC3)C4(CCN(C4)C(=O)OCCF)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)N2)C3CCN(CC3)C4(CCN(C4)C(=O)OCCF)C

InChI

InChI=1S/C21H29FN4O3/c1-15-3-4-18-17(13-15)23-19(27)26(18)16-5-9-25(10-6-16)21(2)7-11-24(14-21)20(28)29-12-8-22/h3-4,13,16H,5-12,14H2,1-2H3,(H,23,27)