3-(2-ethylbutanoylamino)-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(2-ethylbutanoylamino)-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide Openeye Name: 3-(2-ethylbutanoylamino)-N-(4-nitrophenyl)benzofuran-2-carboxamide CAS Name: 3-[(2-ethyl-1-oxobutyl)amino]-N-(4-nitrophenyl)-2-benzofurancarboxamide IUPAC Name: 3-(2-ethylbutanoylamino)-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-(2-ethylbutanoylamino)-N-(4-nitrophenyl)coumarilamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C(=O)NC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-3-13(4-2)20(25)23-18-16-7-5-6-8-17(16)29-19(18)21(26)22-14-9-11-15(12-10-14)24(27)28/h5-13H,3-4H2,1-2H3,(H,22,26)(H,23,25)