N-(1,3-benzodioxol-5-ylmethyl)-N-[(1,5-dimethylpyrazol-3-yl)methyl]quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1,5-dimethylpyrazol-3-yl)methyl]quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1,5-dimethylpyrazol-3-yl)methyl]quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1,5-dimethyl-3-pyrazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1,5-dimethylpyrazol-3-yl)methyl]quinoline-4-carboxamide Traditional Name: N-[(1,5-dimethylpyrazol-3-yl)methyl]-N-piperonyl-cinchoninamide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NC5=CC=CC=C45

Isomeric SMILES

CC1=CC(=NN1C)CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C24H22N4O3/c1-16-11-18(26-27(16)2)14-28(13-17-7-8-22-23(12-17)31-15-30-22)24(29)20-9-10-25-21-6-4-3-5-19(20)21/h3-12H,13-15H2,1-2H3