N-[(2S)-1-[(5-nitro-2-oxidanyl-phenyl)methylamino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[(5-nitro-2-oxidanyl-phenyl)methylamino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-[(2-hydroxy-5-nitro-phenyl)methylamino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[(2-hydroxy-5-nitrophenyl)methylamino]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[(2-hydroxy-5-nitrophenyl)methylamino]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-[(2-hydroxy-5-nitro-benzyl)amino]-2-keto-1-methyl-ethyl]-2-furamide Formula: C15H15N3O6 MolecularWeight: 333.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=C(C=CC(=C1)[N+](=O)[O-])O)NC(=O)C2=CC=CO2

Isomeric SMILES

C[C@@H](C(=O)NCC1=C(C=CC(=C1)[N+](=O)[O-])O)NC(=O)C2=CC=CO2

InChI

InChI=1S/C15H15N3O6/c1-9(17-15(21)13-3-2-6-24-13)14(20)16-8-10-7-11(18(22)23)4-5-12(10)19/h2-7,9,19H,8H2,1H3,(H,16,20)(H,17,21)/t9-/m0/s1