4-[(R)-1H-indol-3-yl-(3-methoxy-4-oxidanyl-phenyl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate

Systemtic Name: 4-[(R)-1H-indol-3-yl-(3-methoxy-4-oxidanyl-phenyl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Openeye Name: 4-[(R)-(4-hydroxy-3-methoxy-phenyl)-(1H-indol-3-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate CAS Name: 4-[(R)-(4-hydroxy-3-methoxyphenyl)-(1H-indol-3-yl)methyl]-5-methyl-2-phenyl-3-pyrazololate IUPAC Name: 4-[(R)-(4-hydroxy-3-methoxyphenyl)-(1H-indol-3-yl)methyl]-5-methyl-2-phenylpyrazol-3-olate Traditional Name: 4-[(R)-(4-hydroxy-3-methoxy-phenyl)-(1H-indol-3-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Formula: C26H22N3O3- MolecularWeight: 424.47118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(C2=CC(=C(C=C2)O)OC)C3=CNC4=CC=CC=C43)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1[C@H](C2=CC(=C(C=C2)O)OC)C3=CNC4=CC=CC=C43)[O-])C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O3/c1-16-24(26(31)29(28-16)18-8-4-3-5-9-18)25(17-12-13-22(30)23(14-17)32-2)20-15-27-21-11-7-6-10-19(20)21/h3-15,25,27,30-31H,1-2H3/p-1/t25-/m1/s1