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

Systemtic Name: N-hexyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]pyrazine-2-carboxamide Openeye Name: N-hexyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-hexyl-N-[3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxopropyl]-2-pyrazinecarboxamide IUPAC Name: N-hexyl-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]pyrazinamide Formula: C20H34N5O3+ MolecularWeight: 392.51566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N5O3/c1-2-3-4-5-10-25(20(27)18-17-21-7-8-22-18)11-6-19(26)23-9-12-24-13-15-28-16-14-24/h7-8,17H,2-6,9-16H2,1H3,(H,23,26)/p+1