4-[[2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-8-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-8-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(2,4-dioxo-1H-benzo[g]pteridin-8-yl)amino]-4-oxo-butanoate CAS Name: 4-[(2,4-dioxo-1H-benzo[g]pteridin-8-yl)amino]-4-oxobutanoate IUPAC Name: 4-[(2,4-dioxo-1H-benzo[g]pteridin-8-yl)amino]-4-oxobutanoate Traditional Name: 4-[(2,4-diketo-1H-benzo[g]pteridin-8-yl)amino]-4-keto-butyrate Formula: C14H10N5O5- MolecularWeight: 328.2597

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CCC(=O)[O-])N=C3C(=N2)C(=O)NC(=O)N3

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CCC(=O)[O-])N=C3C(=N2)C(=O)NC(=O)N3

InChI

InChI=1S/C14H11N5O5/c20-9(3-4-10(21)22)15-6-1-2-7-8(5-6)17-12-11(16-7)13(23)19-14(24)18-12/h1-2,5H,3-4H2,(H,15,20)(H,21,22)(H2,17,18,19,23,24)/p-1