ethyl 3-[[4-(tert-butylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[4-(tert-butylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[4-(tert-butylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-[(tert-butylamino)-oxomethyl]anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(tert-butylcarbamoyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(tert-butylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O6/c1-5-30-20(27)15-10-14(11-17(12-15)24(28)29)18(25)22-16-8-6-13(7-9-16)19(26)23-21(2,3)4/h6-12H,5H2,1-4H3,(H,22,25)(H,23,26)