4-hexadecyl-1H-pyrazin-1-ium-2-carboxamide

Systemtic Name: 4-hexadecyl-1H-pyrazin-1-ium-2-carboxamide Openeye Name: 4-hexadecyl-1H-pyrazin-1-ium-2-carboxamide CAS Name: 4-hexadecyl-1H-pyrazin-1-ium-2-carboxamide IUPAC Name: 4-hexadecyl-1H-pyrazin-1-ium-2-carboxamide Traditional Name: 4-cetyl-1H-pyrazin-1-ium-2-carboxamide Formula: C21H40N3O+ MolecularWeight: 350.5618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C=C[NH2+]C(=C1)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C=C[NH2+]C(=C1)C(=O)N

InChI

InChI=1S/C21H39N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-18-16-23-20(19-24)21(22)25/h16,18-19,23H,2-15,17H2,1H3,(H2,22,25)/p+1