methyl 3-[[(2,4-dimethylphenyl)carbonylamino]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[(2,4-dimethylphenyl)carbonylamino]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[(2,4-dimethylbenzoyl)amino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(2,4-dimethylphenyl)-oxomethyl]hydrazo]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[(2,4-dimethylbenzoyl)amino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(2,4-dimethylbenzoyl)amino]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O6/c1-10-4-5-15(11(2)6-10)17(23)20-19-16(22)12-7-13(18(24)27-3)9-14(8-12)21(25)26/h4-9H,1-3H3,(H,19,22)(H,20,23)