N-(1-adamantylmethyl)-2-chloranyl-5-[3-(hydroxymethylamino)propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-(hydroxymethylamino)propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(hydroxymethylamino)propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(hydroxymethylamino)propyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(hydroxymethylamino)propyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(methylolamino)propyl]benzamide Formula: C22H31ClN2O2 MolecularWeight: 390.94674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31ClN2O2/c23-20-4-3-15(2-1-5-24-14-26)9-19(20)21(27)25-13-22-10-16-6-17(11-22)8-18(7-16)12-22/h3-4,9,16-18,24,26H,1-2,5-8,10-14H2,(H,25,27)