methyl 3-[[(3,5-dimethoxyphenyl)carbonylamino]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[(3,5-dimethoxyphenyl)carbonylamino]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[(3,5-dimethoxybenzoyl)amino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[(3,5-dimethoxybenzoyl)amino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(3,5-dimethoxybenzoyl)amino]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H17N3O8 MolecularWeight: 403.34288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)OC

InChI

InChI=1S/C18H17N3O8/c1-27-14-7-11(8-15(9-14)28-2)17(23)20-19-16(22)10-4-12(18(24)29-3)6-13(5-10)21(25)26/h4-9H,1-3H3,(H,19,22)(H,20,23)