N-(1-adamantylmethyl)-2-chloranyl-5-[3-[(3-methyl-3-oxidanyl-butyl)amino]propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-[(3-methyl-3-oxidanyl-butyl)amino]propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(3-hydroxy-3-methyl-butyl)amino]propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(3-hydroxy-3-methylbutyl)amino]propyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(3-hydroxy-3-methylbutyl)amino]propyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(3-hydroxy-3-methyl-butyl)amino]propyl]benzamide Formula: C26H39ClN2O2 MolecularWeight: 447.05306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCNCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

CC(C)(CCNCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C26H39ClN2O2/c1-25(2,31)7-9-28-8-3-4-18-5-6-23(27)22(13-18)24(30)29-17-26-14-19-10-20(15-26)12-21(11-19)16-26/h5-6,13,19-21,28,31H,3-4,7-12,14-17H2,1-2H3,(H,29,30)