N-(1-adamantylmethyl)-5-chloranyl-2-[3-(3-oxidanylpropylamino)propyl]pyridine-4-carboxamide hydrochloride

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-2-[3-(3-oxidanylpropylamino)propyl]pyridine-4-carboxamide hydrochloride Openeye Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(3-hydroxypropylamino)propyl]pyridine-4-carboxamide hydrochloride CAS Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(3-hydroxypropylamino)propyl]-4-pyridinecarboxamide hydrochloride IUPAC Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(3-hydroxypropylamino)propyl]pyridine-4-carboxamide hydrochloride Traditional Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(3-hydroxypropylamino)propyl]isonicotinamide hydrochloride Formula: C23H35Cl2N3O2 MolecularWeight: 456.4489

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC(=NC=C4Cl)CCCNCCCO.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC(=NC=C4Cl)CCCNCCCO.Cl

InChI

InChI=1S/C23H34ClN3O2.ClH/c24-21-14-26-19(3-1-4-25-5-2-6-28)10-20(21)22(29)27-15-23-11-16-7-17(12-23)9-18(8-16)13-23;/h10,14,16-18,25,28H,1-9,11-13,15H2,(H,27,29);1H