(2R)-N-(1-adamantylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: (2R)-N-[(1-adamantylamino)-oxomethyl]-2-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C19H34N4O2+2 MolecularWeight: 350.49886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)[NH+]4CC[NH+](CC4)C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)[NH+]4CC[NH+](CC4)C

InChI

InChI=1S/C19H32N4O2/c1-13(23-5-3-22(2)4-6-23)17(24)20-18(25)21-19-10-14-7-15(11-19)9-16(8-14)12-19/h13-16H,3-12H2,1-2H3,(H2,20,21,24,25)/p+2/t13-,14?,15?,16?,19?/m1/s1