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

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[2-(3-oxidanylpropylamino)ethylamino]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylamino)ethylamino]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylamino)ethylamino]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylamino)ethylamino]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylamino)ethylamino]benzamide Formula: C23H34ClN3O2 MolecularWeight: 419.98796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34ClN3O2/c24-21-3-2-19(26-6-5-25-4-1-7-28)11-20(21)22(29)27-15-23-12-16-8-17(13-23)10-18(9-16)14-23/h2-3,11,16-18,25-26,28H,1,4-10,12-15H2,(H,27,29)