4-(1,7-naphthyridin-8-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: 4-(1,7-naphthyridin-8-ylamino)-4-oxidanylidene-butanoate Openeye Name: 4-(1,7-naphthyridin-8-ylamino)-4-oxo-butanoate CAS Name: 4-(1,7-naphthyridin-8-ylamino)-4-oxobutanoate IUPAC Name: 4-(1,7-naphthyridin-8-ylamino)-4-oxobutanoate Traditional Name: 4-keto-4-(1,7-naphthyridin-8-ylamino)butyrate Formula: C12H10N3O3- MolecularWeight: 244.2261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=NC=C2)NC(=O)CCC(=O)[O-])N=C1

Isomeric SMILES

C1=CC2=C(C(=NC=C2)NC(=O)CCC(=O)[O-])N=C1

InChI

InChI=1S/C12H11N3O3/c16-9(3-4-10(17)18)15-12-11-8(5-7-14-12)2-1-6-13-11/h1-2,5-7H,3-4H2,(H,17,18)(H,14,15,16)/p-1