sodium 2-[(1-methyl-9-oxidanylidene-4H-pyrazolo[4,3-b]quinolin-7-yl)methyl]phenolate

Systemtic Name: sodium 2-[(1-methyl-9-oxidanylidene-4H-pyrazolo[4,3-b]quinolin-7-yl)methyl]phenolate Openeye Name: sodium 2-[(1-methyl-9-oxo-4H-pyrazolo[4,3-b]quinolin-7-yl)methyl]phenolate CAS Name: sodium 2-[(1-methyl-9-oxo-4H-pyrazolo[4,3-b]quinolin-7-yl)methyl]phenolate IUPAC Name: sodium 2-[(1-methyl-9-oxo-4H-pyrazolo[4,3-b]quinolin-7-yl)methyl]phenolate Traditional Name: sodium 2-[(9-keto-1-methyl-4H-pyrazolo[4,3-b]quinolin-7-yl)methyl]phenolate Formula: C18H14N3NaO2 MolecularWeight: 327.31243

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)NC3=C(C2=O)C=C(C=C3)CC4=CC=CC=C4[O-].[Na+]

Isomeric SMILES

CN1C2=C(C=N1)NC3=C(C2=O)C=C(C=C3)CC4=CC=CC=C4[O-].[Na+]

InChI

InChI=1S/C18H15N3O2.Na/c1-21-17-15(10-19-21)20-14-7-6-11(9-13(14)18(17)23)8-12-4-2-3-5-16(12)22;/h2-7,9-10,22H,8H2,1H3,(H,20,23);/q;+1/p-1