ethyl 3-[[4,5-dimethoxy-2-(methylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[4,5-dimethoxy-2-(methylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[4,5-dimethoxy-2-(methylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4,5-dimethoxy-2-(methylcarbamoyl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[4,5-dimethoxy-2-(methylcarbamoyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4,5-dimethoxy-2-(methylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H21N3O8 MolecularWeight: 431.39604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2C(=O)NC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2C(=O)NC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O8/c1-5-31-20(26)12-6-11(7-13(8-12)23(27)28)18(24)22-15-10-17(30-4)16(29-3)9-14(15)19(25)21-2/h6-10H,5H2,1-4H3,(H,21,25)(H,22,24)