3-[2-(cyclohexen-1-yl)ethyl]-2,6-bis(oxidanylidene)-5-propanoyl-pyrimidin-4-olate; trimethylazanium

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-2,6-bis(oxidanylidene)-5-propanoyl-pyrimidin-4-olate; trimethylazanium Openeye Name: 3-[2-(cyclohexen-1-yl)ethyl]-2,6-dioxo-5-propanoyl-pyrimidin-4-olate; trimethylammonium CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-2,6-dioxo-5-(1-oxopropyl)-4-pyrimidinolate; trimethylammonium IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-2,6-dioxo-5-propanoylpyrimidin-4-olate; trimethylazanium Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-2,6-diketo-5-propionyl-pyrimidin-4-olate; trimethylammonium Formula: C18H29N3O4 MolecularWeight: 351.44056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(C(=O)NC1=O)CCC2=CCCCC2)[O-].C[NH+](C)C

Isomeric SMILES

CCC(=O)C1=C(N(C(=O)NC1=O)CCC2=CCCCC2)[O-].C[NH+](C)C

InChI

InChI=1S/C15H20N2O4.C3H9N/c1-2-11(18)12-13(19)16-15(21)17(14(12)20)9-8-10-6-4-3-5-7-10;1-4(2)3/h6,20H,2-5,7-9H2,1H3,(H,16,19,21);1-3H3