N-(1-adamantylmethyl)-2-chloranyl-5-[3-(3,3-dimethylbutan-2-ylamino)propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-(3,3-dimethylbutan-2-ylamino)propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(1,2,2-trimethylpropylamino)propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(3,3-dimethylbutan-2-ylamino)propyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(3,3-dimethylbutan-2-ylamino)propyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(1,2,2-trimethylpropylamino)propyl]benzamide Formula: C27H41ClN2O MolecularWeight: 445.08024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H41ClN2O/c1-18(26(2,3)4)29-9-5-6-19-7-8-24(28)23(13-19)25(31)30-17-27-14-20-10-21(15-27)12-22(11-20)16-27/h7-8,13,18,20-22,29H,5-6,9-12,14-17H2,1-4H3,(H,30,31)