N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Traditional Name: 6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]-N-piperonyl-cinchoninamide Formula: C30H26N4O3 MolecularWeight: 490.55244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NCC5=CC6=C(C=C5)OCO6)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NCC5=CC6=C(C=C5)OCO6)C

InChI

InChI=1S/C30H26N4O3/c1-18-4-8-22(9-5-18)34-20(3)25(16-32-34)27-14-24(23-12-19(2)6-10-26(23)33-27)30(35)31-15-21-7-11-28-29(13-21)37-17-36-28/h4-14,16H,15,17H2,1-3H3,(H,31,35)