5-[(4-methylphenyl)carbamoyl]-2-nitro-phenolate

Systemtic Name: 5-[(4-methylphenyl)carbamoyl]-2-nitro-phenolate Openeye Name: 2-nitro-5-(p-tolylcarbamoyl)phenolate CAS Name: 5-[(4-methylanilino)-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[(4-methylphenyl)carbamoyl]-2-nitrophenolate Traditional Name: 2-nitro-5-(p-tolylcarbamoyl)phenolate Formula: C14H11N2O4- MolecularWeight: 271.24814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O4/c1-9-2-5-11(6-3-9)15-14(18)10-4-7-12(16(19)20)13(17)8-10/h2-8,17H,1H3,(H,15,18)/p-1