6-chloranyl-N-(cyclohexylmethyl)-2-[3-(3-oxidanylpropylamino)propyl]quinoline-5-carboxamide

Systemtic Name: 6-chloranyl-N-(cyclohexylmethyl)-2-[3-(3-oxidanylpropylamino)propyl]quinoline-5-carboxamide Openeye Name: 6-chloro-N-(cyclohexylmethyl)-2-[3-(3-hydroxypropylamino)propyl]quinoline-5-carboxamide CAS Name: 6-chloro-N-(cyclohexylmethyl)-2-[3-(3-hydroxypropylamino)propyl]-5-quinolinecarboxamide IUPAC Name: 6-chloro-N-(cyclohexylmethyl)-2-[3-(3-hydroxypropylamino)propyl]quinoline-5-carboxamide Traditional Name: 6-chloro-N-(cyclohexylmethyl)-2-[3-(3-hydroxypropylamino)propyl]quinoline-5-carboxamide Formula: C23H32ClN3O2 MolecularWeight: 417.97208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C2=C(C=CC3=C2C=CC(=N3)CCCNCCCO)Cl

Isomeric SMILES

C1CCC(CC1)CNC(=O)C2=C(C=CC3=C2C=CC(=N3)CCCNCCCO)Cl

InChI

InChI=1S/C23H32ClN3O2/c24-20-11-12-21-19(10-9-18(27-21)8-4-13-25-14-5-15-28)22(20)23(29)26-16-17-6-2-1-3-7-17/h9-12,17,25,28H,1-8,13-16H2,(H,26,29)