4-[(R)-1H-indol-3-yl-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate

Systemtic Name: 4-[(R)-1H-indol-3-yl-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate Openeye Name: 4-[(R)-1H-indol-3-yl-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate CAS Name: 4-[(R)-1H-indol-3-yl-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate IUPAC Name: 4-[(R)-1H-indol-3-yl-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate Traditional Name: 4-[(R)-1H-indol-3-yl-(3-keto-5-methyl-3-pyrazolin-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate Formula: C17H16N5O2- MolecularWeight: 322.34124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C(C2=CNC3=CC=CC=C32)C4=C(NN=C4[O-])C

Isomeric SMILES

CC1=C(C(=O)NN1)[C@H](C2=CNC3=CC=CC=C32)C4=C(NN=C4[O-])C

InChI

InChI=1S/C17H17N5O2/c1-8-13(16(23)21-19-8)15(14-9(2)20-22-17(14)24)11-7-18-12-6-4-3-5-10(11)12/h3-7,15,18H,1-2H3,(H2,19,21,23)(H2,20,22,24)/p-1