ethyl (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-acrylic acid ethyl ester Formula: C13H10ClNO4 MolecularWeight: 279.6758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC2=C(C(=C1)Cl)OCO2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC2=C(C(=C1)Cl)OCO2)/C#N

InChI

InChI=1S/C13H10ClNO4/c1-2-17-13(16)9(6-15)3-8-4-10(14)12-11(5-8)18-7-19-12/h3-5H,2,7H2,1H3/b9-3+