[(Z)-[azanyl-(1,5-dimethylpyrrol-2-yl)methylidene]amino] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [(Z)-[azanyl-(1,5-dimethylpyrrol-2-yl)methylidene]amino] 1,3-benzodioxole-5-carboxylate Openeye Name: [(Z)-[amino-(1,5-dimethylpyrrol-2-yl)methylene]amino] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [(Z)-[amino-(1,5-dimethyl-2-pyrrolyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(1,5-dimethylpyrrol-2-yl)methylidene]amino] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [(Z)-[amino-(1,5-dimethylpyrrol-2-yl)methylene]amino] ester Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)C(=NOC(=O)C2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

CC1=CC=C(N1C)/C(=N/OC(=O)C2=CC3=C(C=C2)OCO3)/N

InChI

InChI=1S/C15H15N3O4/c1-9-3-5-11(18(9)2)14(16)17-22-15(19)10-4-6-12-13(7-10)21-8-20-12/h3-7H,8H2,1-2H3,(H2,16,17)