3-hex-1-ynyl-5-nitro-3-oxidanyl-1H-indol-2-one

Systemtic Name: 3-hex-1-ynyl-5-nitro-3-oxidanyl-1H-indol-2-one Openeye Name: 3-hex-1-ynyl-3-hydroxy-5-nitro-indolin-2-one CAS Name: 3-hex-1-ynyl-3-hydroxy-5-nitro-1H-indol-2-one IUPAC Name: 3-hex-1-ynyl-3-hydroxy-5-nitro-1H-indol-2-one Traditional Name: 3-hex-1-ynyl-3-hydroxy-5-nitro-oxindole Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C2=C(C=CC(=C2)[N+](=O)[O-])NC1=O)O

Isomeric SMILES

CCCCC#CC1(C2=C(C=CC(=C2)[N+](=O)[O-])NC1=O)O

InChI

InChI=1S/C14H14N2O4/c1-2-3-4-5-8-14(18)11-9-10(16(19)20)6-7-12(11)15-13(14)17/h6-7,9,18H,2-4H2,1H3,(H,15,17)