5-[1-[3-(diethylazaniumyl)propylamino]ethylidene]-4,6-bis(oxidanylidene)-1-prop-2-enyl-pyrimidin-2-olate

Systemtic Name: 5-[1-[3-(diethylazaniumyl)propylamino]ethylidene]-4,6-bis(oxidanylidene)-1-prop-2-enyl-pyrimidin-2-olate Openeye Name: 1-allyl-5-[1-[3-(diethylammonio)propylamino]ethylidene]-4,6-dioxo-pyrimidin-2-olate CAS Name: 5-[1-[3-(diethylammonio)propylamino]ethylidene]-4,6-dioxo-1-prop-2-enyl-2-pyrimidinolate IUPAC Name: 5-[1-[3-(diethylazaniumyl)propylamino]ethylidene]-4,6-dioxo-1-prop-2-enylpyrimidin-2-olate Traditional Name: 1-allyl-5-[1-[3-(diethylammonio)propylamino]ethylidene]-4,6-diketo-pyrimidin-2-olate Formula: C16H26N4O3 MolecularWeight: 322.40264

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=C1C(=O)N=C(N(C1=O)CC=C)[O-])C

Isomeric SMILES

CC[NH+](CC)CCCNC(=C1C(=O)N=C(N(C1=O)CC=C)[O-])C

InChI

InChI=1S/C16H26N4O3/c1-5-10-20-15(22)13(14(21)18-16(20)23)12(4)17-9-8-11-19(6-2)7-3/h5,17H,1,6-11H2,2-4H3,(H,18,21,23)