2-[(4-methyl-2-nitro-phenyl)carbamoyl]terephthalate

Systemtic Name: 2-[(4-methyl-2-nitro-phenyl)carbamoyl]terephthalate Openeye Name: 2-[(4-methyl-2-nitro-phenyl)carbamoyl]terephthalate CAS Name: 2-[(4-methyl-2-nitroanilino)-oxomethyl]terephthalate IUPAC Name: 2-[(4-methyl-2-nitrophenyl)carbamoyl]terephthalate Traditional Name: 2-[(4-methyl-2-nitro-phenyl)carbamoyl]terephthalate Formula: C16H10N2O7-2 MolecularWeight: 342.2598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O7/c1-8-2-5-12(13(6-8)18(24)25)17-14(19)11-7-9(15(20)21)3-4-10(11)16(22)23/h2-7H,1H3,(H,17,19)(H,20,21)(H,22,23)/p-2