4-azanyl-1-[(2S)-butan-2-yl]-2-oxidanylidene-1,8-naphthyridine-3-carboxylate

Systemtic Name: 4-azanyl-1-[(2S)-butan-2-yl]-2-oxidanylidene-1,8-naphthyridine-3-carboxylate Openeye Name: 4-amino-1-[(1S)-1-methylpropyl]-2-oxo-1,8-naphthyridine-3-carboxylate CAS Name: 4-amino-1-[(2S)-butan-2-yl]-2-oxo-1,8-naphthyridine-3-carboxylate IUPAC Name: 4-amino-1-[(2S)-butan-2-yl]-2-oxo-1,8-naphthyridine-3-carboxylate Traditional Name: 4-amino-2-keto-1-[(1S)-1-methylpropyl]-1,8-naphthyridine-3-carboxylate Formula: C13H14N3O3- MolecularWeight: 260.26856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=CC=N2)C(=C(C1=O)C(=O)[O-])N

Isomeric SMILES

CC[C@H](C)N1C2=C(C=CC=N2)C(=C(C1=O)C(=O)[O-])N

InChI

InChI=1S/C13H15N3O3/c1-3-7(2)16-11-8(5-4-6-15-11)10(14)9(12(16)17)13(18)19/h4-7H,3,14H2,1-2H3,(H,18,19)/p-1/t7-/m0/s1