N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-5-phenylmethoxy-indole-2-carboxamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-5-phenylmethoxy-indole-2-carboxamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-5-benzyloxy-1-methyl-indole-2-carboxamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-5-phenylmethoxy-2-indolecarboxamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-5-phenylmethoxyindole-2-carboxamide Traditional Name: 5-benzoxy-1-methyl-N-[(E)-piperonylideneamino]indole-2-carboxamide Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OCC3=CC=CC=C3)C=C1C(=O)NN=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C2=C(C=C(C=C2)OCC3=CC=CC=C3)C=C1C(=O)N/N=C/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H21N3O4/c1-28-21-9-8-20(30-15-17-5-3-2-4-6-17)12-19(21)13-22(28)25(29)27-26-14-18-7-10-23-24(11-18)32-16-31-23/h2-14H,15-16H2,1H3,(H,27,29)/b26-14+