N-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-methyl-4-(2-oxo-1-piperidyl)phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-methyl-4-(2-oxo-1-piperidinyl)phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-methyl-4-(2-oxopiperidin-1-yl)phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-(2-ketopiperidino)-3-methyl-phenyl]-5-nitro-2-furamide Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])N3CCCCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])N3CCCCC3=O

InChI

InChI=1S/C17H17N3O5/c1-11-10-12(5-6-13(11)19-9-3-2-4-15(19)21)18-17(22)14-7-8-16(25-14)20(23)24/h5-8,10H,2-4,9H2,1H3,(H,18,22)