2-methoxy-6-nitro-4-[(2S)-3-[(Z)-1-(4-nitrophenyl)ethylideneamino]-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(2S)-3-[(Z)-1-(4-nitrophenyl)ethylideneamino]-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(2S)-3-[(Z)-1-(4-nitrophenyl)ethylideneamino]-4-oxo-1,2-dihydroquinazolin-2-yl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(2S)-3-[(Z)-1-(4-nitrophenyl)ethylideneamino]-4-oxo-1,2-dihydroquinazolin-2-yl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(2S)-3-[(Z)-1-(4-nitrophenyl)ethylideneamino]-4-oxo-1,2-dihydroquinazolin-2-yl]phenolate Traditional Name: 4-[(2S)-4-keto-3-[(Z)-1-(4-nitrophenyl)ethylideneamino]-1,2-dihydroquinazolin-2-yl]-2-methoxy-6-nitro-phenolate Formula: C23H18N5O7- MolecularWeight: 476.41832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C/C(=N/N1[C@H](NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O7/c1-13(14-7-9-16(10-8-14)27(31)32)25-26-22(24-18-6-4-3-5-17(18)23(26)30)15-11-19(28(33)34)21(29)20(12-15)35-2/h3-12,22,24,29H,1-2H3/p-1/b25-13-/t22-/m0/s1