2-[(3-methylphenyl)carbamoyl]-4,6-dinitro-phenolate

Systemtic Name: 2-[(3-methylphenyl)carbamoyl]-4,6-dinitro-phenolate Openeye Name: 2-(m-tolylcarbamoyl)-4,6-dinitro-phenolate CAS Name: 2-[(3-methylanilino)-oxomethyl]-4,6-dinitrophenolate IUPAC Name: 2-[(3-methylphenyl)carbamoyl]-4,6-dinitrophenolate Traditional Name: 2-(m-tolylcarbamoyl)-4,6-dinitro-phenolate Formula: C14H10N3O6- MolecularWeight: 316.2457

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O6/c1-8-3-2-4-9(5-8)15-14(19)11-6-10(16(20)21)7-12(13(11)18)17(22)23/h2-7,18H,1H3,(H,15,19)/p-1