2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-ethylpyrazol-4-yl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-ethylpyrazol-4-yl)methyl]quinoline-4-carboxamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-ethylpyrazol-4-yl)methyl]quinoline-4-carboxamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-ethyl-4-pyrazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-ethylpyrazol-4-yl)methyl]quinoline-4-carboxamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-ethylpyrazol-4-yl)methyl]cinchoninamide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCN1C=C(C=N1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

InChI

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