sodium 3-[(2,4-dinitrophenyl)amino]-4-methoxy-benzoate

Systemtic Name: sodium 3-[(2,4-dinitrophenyl)amino]-4-methoxy-benzoate Openeye Name: sodium 3-(2,4-dinitroanilino)-4-methoxy-benzoate CAS Name: sodium 3-(2,4-dinitroanilino)-4-methoxybenzoate IUPAC Name: sodium 3-(2,4-dinitroanilino)-4-methoxybenzoate Traditional Name: sodium 3-(2,4-dinitroanilino)-4-methoxy-benzoate Formula: C14H10N3NaO7 MolecularWeight: 355.23487

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C14H11N3O7.Na/c1-24-13-5-2-8(14(18)19)6-11(13)15-10-4-3-9(16(20)21)7-12(10)17(22)23;/h2-7,15H,1H3,(H,18,19);/q;+1/p-1