N-[(Z)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]quinoline-2-carboxamide

Systemtic Name: N-[(Z)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]quinoline-2-carboxamide Openeye Name: N-[(Z)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]quinoline-2-carboxamide CAS Name: N-[(Z)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-quinolinecarboxamide IUPAC Name: N-[(Z)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methylideneamino]quinoline-2-carboxamide Traditional Name: N-[(Z)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]quinaldamide Formula: C28H21N5O3 MolecularWeight: 475.49804

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=NNC(=O)C4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3/C=N\NC(=O)C4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6

InChI

InChI=1S/C28H21N5O3/c34-28(24-12-10-19-6-4-5-9-23(19)30-24)31-29-17-21-18-33(22-7-2-1-3-8-22)32-27(21)20-11-13-25-26(16-20)36-15-14-35-25/h1-13,16-18H,14-15H2,(H,31,34)/b29-17-