ethoxycarbonyl (NZ,2E)-N-(1,3-benzodioxol-5-ylmethylidene)-1-methyl-indole-2-carbohydrazonate

Systemtic Name: ethoxycarbonyl (NZ,2E)-N-(1,3-benzodioxol-5-ylmethylidene)-1-methyl-indole-2-carbohydrazonate Openeye Name: ethoxycarbonyl (NZ,2E)-N-(1,3-benzodioxol-5-ylmethylene)-1-methyl-indole-2-carbohydrazonate CAS Name: (NZ,2E)-N-(1,3-benzodioxol-5-ylmethylidene)-1-methyl-2-indolecarbohydrazonic acid ethoxycarbonyl ester IUPAC Name: ethoxycarbonyl (NZ,2E)-N-(1,3-benzodioxol-5-ylmethylidene)-1-methylindole-2-carbohydrazonate Traditional Name: (NZ,2E)-1-methyl-N-piperonylidene-indole-2-carbohydrazonic acid carbethoxy ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(=NN=CC1=CC2=C(C=C1)OCO2)C3=CC4=CC=CC=C4N3C

Isomeric SMILES

CCOC(=O)O/C(=N/N=C\C1=CC2=C(C=C1)OCO2)/C3=CC4=CC=CC=C4N3C

InChI

InChI=1S/C21H19N3O5/c1-3-26-21(25)29-20(17-11-15-6-4-5-7-16(15)24(17)2)23-22-12-14-8-9-18-19(10-14)28-13-27-18/h4-12H,3,13H2,1-2H3/b22-12-,23-20+