(E)-2-morpholin-4-ylcarbonyl-3-(4-oxidanylidene-2-piperidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-morpholin-4-ylcarbonyl-3-(4-oxidanylidene-2-piperidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(morpholine-4-carbonyl)-3-[4-oxo-2-(1-piperidyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enenitrile CAS Name: (E)-2-[4-morpholinyl(oxo)methyl]-3-[4-oxo-2-(1-piperidinyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-2-propenenitrile IUPAC Name: (E)-2-(morpholine-4-carbonyl)-3-(4-oxo-2-piperidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-keto-2-piperidino-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-(morpholine-4-carbonyl)acrylonitrile Formula: C21H24N5O3+ MolecularWeight: 394.44696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)[N+]3=CC=CC=C3N2)C=C(C#N)C(=O)N4CCOCC4

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)[N+]3=CC=CC=C3N2)/C=C(\C#N)/C(=O)N4CCOCC4

InChI

InChI=1S/C21H23N5O3/c22-15-16(20(27)25-10-12-29-13-11-25)14-17-19(24-7-3-1-4-8-24)23-18-6-2-5-9-26(18)21(17)28/h2,5-6,9,14H,1,3-4,7-8,10-13H2/p+1/b16-14+