ethyl 3-[[2-chloranyl-5-(dimethylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[2-chloranyl-5-(dimethylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[2-chloro-5-(dimethylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[2-chloro-5-[dimethylamino(oxo)methyl]anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-chloro-5-(dimethylcarbamoyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-chloro-5-(dimethylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H18ClN3O6 MolecularWeight: 419.81572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N(C)C)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N(C)C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN3O6/c1-4-29-19(26)13-7-12(8-14(9-13)23(27)28)17(24)21-16-10-11(5-6-15(16)20)18(25)22(2)3/h5-10H,4H2,1-3H3,(H,21,24)