N-hexyl-5-methyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]pyrazine-2-carboxamide

Systemtic Name: N-hexyl-5-methyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]pyrazine-2-carboxamide Openeye Name: N-hexyl-5-methyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-hexyl-5-methyl-N-[3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxopropyl]-2-pyrazinecarboxamide IUPAC Name: N-hexyl-5-methyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-hexyl-N-[3-keto-3-(2-morpholin-4-ium-4-ylethylamino)propyl]-5-methyl-pyrazinamide Formula: C21H36N5O3+ MolecularWeight: 406.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCC(=O)NCC[NH+]1CCOCC1)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CCCCCCN(CCC(=O)NCC[NH+]1CCOCC1)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C21H35N5O3/c1-3-4-5-6-9-26(21(28)19-17-23-18(2)16-24-19)10-7-20(27)22-8-11-25-12-14-29-15-13-25/h16-17H,3-15H2,1-2H3,(H,22,27)/p+1