4-(2-aminophenyl)-2-[(2,4-dinitrophenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-aminophenyl)-2-[(2,4-dinitrophenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-aminophenyl)-2-(2,4-dinitroanilino)-4-oxo-butanoic acid CAS Name: 4-(2-aminophenyl)-2-(2,4-dinitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(2-aminophenyl)-2-(2,4-dinitroanilino)-4-oxobutanoic acid Traditional Name: 4-(2-aminophenyl)-2-(2,4-dinitroanilino)-4-keto-butyric acid Formula: C16H14N4O7 MolecularWeight: 374.30496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)CC(C(=O)O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)CC(C(=O)O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])N

InChI

InChI=1S/C16H14N4O7/c17-11-4-2-1-3-10(11)15(21)8-13(16(22)23)18-12-6-5-9(19(24)25)7-14(12)20(26)27/h1-7,13,18H,8,17H2,(H,22,23)