N-[(Z)-[4-(2-morpholin-4-ium-4-ylethylamino)-4-oxidanylidene-butan-2-ylidene]amino]adamantane-1-carboxamide

Systemtic Name: N-[(Z)-[4-(2-morpholin-4-ium-4-ylethylamino)-4-oxidanylidene-butan-2-ylidene]amino]adamantane-1-carboxamide Openeye Name: N-[(Z)-[1-methyl-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propylidene]amino]adamantane-1-carboxamide CAS Name: N-[(Z)-[4-[2-(4-morpholin-4-iumyl)ethylamino]-4-oxobutan-2-ylidene]amino]-1-adamantanecarboxamide IUPAC Name: N-[(Z)-[4-(2-morpholin-4-ium-4-ylethylamino)-4-oxobutan-2-ylidene]amino]adamantane-1-carboxamide Traditional Name: N-[(Z)-[3-keto-1-methyl-3-(2-morpholin-4-ium-4-ylethylamino)propylidene]amino]adamantane-1-carboxamide Formula: C21H35N4O3+ MolecularWeight: 391.5276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C12CC3CC(C1)CC(C3)C2)CC(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

C/C(=N/NC(=O)C12CC3CC(C1)CC(C3)C2)/CC(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C21H34N4O3/c1-15(8-19(26)22-2-3-25-4-6-28-7-5-25)23-24-20(27)21-12-16-9-17(13-21)11-18(10-16)14-21/h16-18H,2-14H2,1H3,(H,22,26)(H,24,27)/p+1/b23-15-