ethyl (5Z)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-2,4-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl (5Z)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-2,4-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl (5Z)-5-(1,3-benzodioxol-5-ylhydrazono)-2,4-dimethyl-pyrrole-3-carboxylate CAS Name: (5Z)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-2,4-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-2,4-dimethylpyrrole-3-carboxylate Traditional Name: (5Z)-5-(1,3-benzodioxol-5-ylhydrazono)-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NNC2=CC3=C(C=C2)OCO3)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(/C(=N/NC2=CC3=C(C=C2)OCO3)/N=C1C)C

InChI

InChI=1S/C16H17N3O4/c1-4-21-16(20)14-9(2)15(17-10(14)3)19-18-11-5-6-12-13(7-11)23-8-22-12/h5-7,18H,4,8H2,1-3H3/b19-15-