5-cyano-4-methyl-6-oxidanylidene-1-propyl-3-(pyrrolidin-1-ium-1-ylmethyl)pyridin-2-olate

Systemtic Name: 5-cyano-4-methyl-6-oxidanylidene-1-propyl-3-(pyrrolidin-1-ium-1-ylmethyl)pyridin-2-olate Openeye Name: 5-cyano-4-methyl-6-oxo-1-propyl-3-(pyrrolidin-1-ium-1-ylmethyl)pyridin-2-olate CAS Name: 5-cyano-4-methyl-6-oxo-1-propyl-3-(1-pyrrolidin-1-iumylmethyl)-2-pyridinolate IUPAC Name: 5-cyano-4-methyl-6-oxo-1-propyl-3-(pyrrolidin-1-ium-1-ylmethyl)pyridin-2-olate Traditional Name: 5-cyano-6-keto-4-methyl-1-propyl-3-(pyrrolidin-1-ium-1-ylmethyl)pyridin-2-olate Formula: C15H21N3O2 MolecularWeight: 275.34614

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=C(C1=O)C#N)C)C[NH+]2CCCC2)[O-]

Isomeric SMILES

CCCN1C(=C(C(=C(C1=O)C#N)C)C[NH+]2CCCC2)[O-]

InChI

InChI=1S/C15H21N3O2/c1-3-6-18-14(19)12(9-16)11(2)13(15(18)20)10-17-7-4-5-8-17/h20H,3-8,10H2,1-2H3