2-[[(3S)-2,4-bis(oxidanylidene)-1-prop-2-enyl-quinolin-3-yl]carbonylamino]-4-nitro-phenolate

Systemtic Name: 2-[[(3S)-2,4-bis(oxidanylidene)-1-prop-2-enyl-quinolin-3-yl]carbonylamino]-4-nitro-phenolate Openeye Name: 2-[[(3S)-1-allyl-2,4-dioxo-quinoline-3-carbonyl]amino]-4-nitro-phenolate CAS Name: 2-[[[(3S)-2,4-dioxo-1-prop-2-enyl-3-quinolinyl]-oxomethyl]amino]-4-nitrophenolate IUPAC Name: 2-[[(3S)-2,4-dioxo-1-prop-2-enylquinoline-3-carbonyl]amino]-4-nitrophenolate Traditional Name: 2-[[(3S)-1-allyl-2,4-diketo-quinoline-3-carbonyl]amino]-4-nitro-phenolate Formula: C19H14N3O6- MolecularWeight: 380.33096

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2C(=O)C(C1=O)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C=CCN1C2=CC=CC=C2C(=O)[C@H](C1=O)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H15N3O6/c1-2-9-21-14-6-4-3-5-12(14)17(24)16(19(21)26)18(25)20-13-10-11(22(27)28)7-8-15(13)23/h2-8,10,16,23H,1,9H2,(H,20,25)/p-1/t16-/m0/s1