5-heptanoyl-3-(2-methoxyphenyl)-2,6-bis(oxidanylidene)pyrimidin-4-olate; trimethylazanium

Systemtic Name: 5-heptanoyl-3-(2-methoxyphenyl)-2,6-bis(oxidanylidene)pyrimidin-4-olate; trimethylazanium Openeye Name: 5-heptanoyl-3-(2-methoxyphenyl)-2,6-dioxo-pyrimidin-4-olate; trimethylammonium CAS Name: 3-(2-methoxyphenyl)-2,6-dioxo-5-(1-oxoheptyl)-4-pyrimidinolate; trimethylammonium IUPAC Name: 5-heptanoyl-3-(2-methoxyphenyl)-2,6-dioxopyrimidin-4-olate; trimethylazanium Traditional Name: 5-enanthyl-2,6-diketo-3-(2-methoxyphenyl)pyrimidin-4-olate; trimethylammonium Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=C(N(C(=O)NC1=O)C2=CC=CC=C2OC)[O-].C[NH+](C)C

Isomeric SMILES

CCCCCCC(=O)C1=C(N(C(=O)NC1=O)C2=CC=CC=C2OC)[O-].C[NH+](C)C

InChI

InChI=1S/C18H22N2O5.C3H9N/c1-3-4-5-6-10-13(21)15-16(22)19-18(24)20(17(15)23)12-9-7-8-11-14(12)25-2;1-4(2)3/h7-9,11,23H,3-6,10H2,1-2H3,(H,19,22,24);1-3H3