N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-cyclopropyl-quinoline-4-carboxamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-cyclopropyl-quinoline-4-carboxamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-cyclopropyl-4-quinolinecarboxamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-cyclopropylquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[(E)-piperonylideneamino]cinchoninamide Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17N3O3/c25-21(24-22-11-13-5-8-19-20(9-13)27-12-26-19)16-10-18(14-6-7-14)23-17-4-2-1-3-15(16)17/h1-5,8-11,14H,6-7,12H2,(H,24,25)/b22-11+