5-butyl-2-(4-methoxyphenyl)-6-(4-methylphenyl)pyrazolo[5,1-a]isoquinoline

Systemtic Name: 5-butyl-2-(4-methoxyphenyl)-6-(4-methylphenyl)pyrazolo[5,1-a]isoquinoline Openeye Name: 5-butyl-2-(4-methoxyphenyl)-6-(p-tolyl)pyrazolo[5,1-a]isoquinoline CAS Name: 5-butyl-2-(4-methoxyphenyl)-6-(4-methylphenyl)pyrazolo[5,1-a]isoquinoline IUPAC Name: 5-butyl-2-(4-methoxyphenyl)-6-(4-methylphenyl)pyrazolo[5,1-a]isoquinoline Traditional Name: 5-butyl-2-(4-methoxyphenyl)-6-(p-tolyl)pyrazol[5,1-a]isoquinoline Formula: C29H28N2O MolecularWeight: 420.54542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2C3=CC(=NN31)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2C3=CC(=NN31)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)C

InChI

InChI=1S/C29H28N2O/c1-4-5-10-27-29(22-13-11-20(2)12-14-22)25-9-7-6-8-24(25)28-19-26(30-31(27)28)21-15-17-23(32-3)18-16-21/h6-9,11-19H,4-5,10H2,1-3H3