N-[(2S)-3-methyl-1-[(3-nitrophenyl)amino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-3-methyl-1-[(3-nitrophenyl)amino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-methyl-1-[(3-nitrophenyl)carbamoyl]propyl]furan-2-carboxamide CAS Name: N-[(2S)-3-methyl-1-(3-nitroanilino)-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-3-methyl-1-(3-nitroanilino)-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-methyl-1-[(3-nitrophenyl)carbamoyl]propyl]-2-furamide Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CO2

InChI

InChI=1S/C16H17N3O5/c1-10(2)14(18-15(20)13-7-4-8-24-13)16(21)17-11-5-3-6-12(9-11)19(22)23/h3-10,14H,1-2H3,(H,17,21)(H,18,20)/t14-/m0/s1