methyl 3-nitro-5-[(2,4,6-trimethylphenyl)carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[(2,4,6-trimethylphenyl)carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[(2,4,6-trimethylphenyl)carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-(2,4,6-trimethylanilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[(2,4,6-trimethylphenyl)carbamoyl]benzoate Traditional Name: 3-(mesitylcarbamoyl)-5-nitro-benzoic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5/c1-10-5-11(2)16(12(3)6-10)19-17(21)13-7-14(18(22)25-4)9-15(8-13)20(23)24/h5-9H,1-4H3,(H,19,21)