2-cyclopentyl-5-diazonio-2-[2-(3-hydroxyphenyl)ethyl]-4-oxidanylidene-3H-pyran-6-olate

Systemtic Name: 2-cyclopentyl-5-diazonio-2-[2-(3-hydroxyphenyl)ethyl]-4-oxidanylidene-3H-pyran-6-olate Openeye Name: 2-cyclopentyl-5-diazonio-2-[2-(3-hydroxyphenyl)ethyl]-4-oxo-3H-pyran-6-olate CAS Name: 2-cyclopentyl-5-diazonio-2-[2-(3-hydroxyphenyl)ethyl]-4-oxo-3H-pyran-6-olate IUPAC Name: 2-cyclopentyl-5-diazonio-2-[2-(3-hydroxyphenyl)ethyl]-4-oxo-3H-pyran-6-olate Traditional Name: 2-cyclopentyl-5-diazonio-2-[2-(3-hydroxyphenyl)ethyl]-4-keto-3H-pyran-6-olate Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2(CC(=O)C(=C(O2)[O-])[N+]#N)CCC3=CC(=CC=C3)O

Isomeric SMILES

C1CCC(C1)C2(CC(=O)C(=C(O2)[O-])[N+]#N)CCC3=CC(=CC=C3)O

InChI

InChI=1S/C18H20N2O4/c19-20-16-15(22)11-18(24-17(16)23,13-5-1-2-6-13)9-8-12-4-3-7-14(21)10-12/h3-4,7,10,13H,1-2,5-6,8-9,11H2,(H-,21,22,23)