N-(1-adamantylmethyl)-2-chloranyl-5-[3-(3-oxidanylpropylamino)propoxy]benzamide hydrochloride

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-(3-oxidanylpropylamino)propoxy]benzamide hydrochloride Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(3-hydroxypropylamino)propoxy]benzamide hydrochloride CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(3-hydroxypropylamino)propoxy]benzamide hydrochloride IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(3-hydroxypropylamino)propoxy]benzamide hydrochloride Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(3-hydroxypropylamino)propoxy]benzamide hydrochloride Formula: C24H36Cl2N2O3 MolecularWeight: 471.46024

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)OCCCNCCCO)Cl.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)OCCCNCCCO)Cl.Cl

InChI

InChI=1S/C24H35ClN2O3.ClH/c25-22-4-3-20(30-8-2-6-26-5-1-7-28)12-21(22)23(29)27-16-24-13-17-9-18(14-24)11-19(10-17)15-24;/h3-4,12,17-19,26,28H,1-2,5-11,13-16H2,(H,27,29);1H