N-[6-chloranyl-2-[(3R)-3-(methylamino)pyrrolidin-1-yl]quinolin-5-yl]-2-cyclohexyl-ethanamide

Systemtic Name: N-[6-chloranyl-2-[(3R)-3-(methylamino)pyrrolidin-1-yl]quinolin-5-yl]-2-cyclohexyl-ethanamide Openeye Name: N-[6-chloro-2-[(3R)-3-(methylamino)pyrrolidin-1-yl]-5-quinolyl]-2-cyclohexyl-acetamide CAS Name: N-[6-chloro-2-[(3R)-3-(methylamino)-1-pyrrolidinyl]-5-quinolinyl]-2-cyclohexylacetamide IUPAC Name: N-[6-chloro-2-[(3R)-3-(methylamino)pyrrolidin-1-yl]quinolin-5-yl]-2-cyclohexylacetamide Traditional Name: N-[6-chloro-2-[(3R)-3-(methylamino)pyrrolidino]-5-quinolyl]-2-cyclohexyl-acetamide Formula: C22H29ClN4O MolecularWeight: 400.94486

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CCN(C1)C2=NC3=C(C=C2)C(=C(C=C3)Cl)NC(=O)CC4CCCCC4

Isomeric SMILES

CN[C@@H]1CCN(C1)C2=NC3=C(C=C2)C(=C(C=C3)Cl)NC(=O)CC4CCCCC4

InChI

InChI=1S/C22H29ClN4O/c1-24-16-11-12-27(14-16)20-10-7-17-19(25-20)9-8-18(23)22(17)26-21(28)13-15-5-3-2-4-6-15/h7-10,15-16,24H,2-6,11-14H2,1H3,(H,26,28)/t16-/m1/s1