N-(1-adamantylmethyl)-2-chloranyl-5-[3-[(3,3-dimethyl-1-oxidanyl-butan-2-yl)amino]propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-[(3,3-dimethyl-1-oxidanyl-butan-2-yl)amino]propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[[1-(hydroxymethyl)-2,2-dimethyl-propyl]amino]propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(1-hydroxy-3,3-dimethylbutan-2-yl)amino]propyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(1-hydroxy-3,3-dimethylbutan-2-yl)amino]propyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[(2,2-dimethyl-1-methylol-propyl)amino]propyl]benzamide Formula: C27H41ClN2O2 MolecularWeight: 461.07964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CO)NCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C)C(CO)NCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H41ClN2O2/c1-26(2,3)24(16-31)29-8-4-5-18-6-7-23(28)22(12-18)25(32)30-17-27-13-19-9-20(14-27)11-21(10-19)15-27/h6-7,12,19-21,24,29,31H,4-5,8-11,13-17H2,1-3H3,(H,30,32)