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

Systemtic Name: 3-(3-methylbutanoylamino)-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide Openeye Name: 3-(3-methylbutanoylamino)-N-(4-nitrophenyl)benzofuran-2-carboxamide CAS Name: 3-[(3-methyl-1-oxobutyl)amino]-N-(4-nitrophenyl)-2-benzofurancarboxamide IUPAC Name: 3-(3-methylbutanoylamino)-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-(isovalerylamino)-N-(4-nitrophenyl)coumarilamide Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5/c1-12(2)11-17(24)22-18-15-5-3-4-6-16(15)28-19(18)20(25)21-13-7-9-14(10-8-13)23(26)27/h3-10,12H,11H2,1-2H3,(H,21,25)(H,22,24)