(4Z)-3-methyl-4-[[5-(3-nitro-4-piperidin-1-yl-phenyl)furan-2-yl]methylidene]-1,2-oxazol-5-one

Systemtic Name: (4Z)-3-methyl-4-[[5-(3-nitro-4-piperidin-1-yl-phenyl)furan-2-yl]methylidene]-1,2-oxazol-5-one Openeye Name: (4Z)-3-methyl-4-[[5-[3-nitro-4-(1-piperidyl)phenyl]-2-furyl]methylene]isoxazol-5-one CAS Name: (4Z)-3-methyl-4-[[5-[3-nitro-4-(1-piperidinyl)phenyl]-2-furanyl]methylidene]-5-isoxazolone IUPAC Name: (4Z)-3-methyl-4-[[5-(3-nitro-4-piperidin-1-ylphenyl)furan-2-yl]methylidene]-1,2-oxazol-5-one Traditional Name: (4Z)-3-methyl-4-[[5-(3-nitro-4-piperidino-phenyl)-2-furyl]methylene]-2-isoxazolin-5-one Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=O)C1=CC2=CC=C(O2)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC\1=NOC(=O)/C1=C\C2=CC=C(O2)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5/c1-13-16(20(24)28-21-13)12-15-6-8-19(27-15)14-5-7-17(18(11-14)23(25)26)22-9-3-2-4-10-22/h5-8,11-12H,2-4,9-10H2,1H3/b16-12-