ethyl 3-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[[3-[dimethylamino(oxo)methyl]phenyl]methylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[[3-(dimethylcarbamoyl)benzyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=CC(=C2)C(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=CC(=C2)C(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c1-4-29-20(26)16-9-15(10-17(11-16)23(27)28)18(24)21-12-13-6-5-7-14(8-13)19(25)22(2)3/h5-11H,4,12H2,1-3H3,(H,21,24)