methyl (E)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-acrylic acid methyl ester Formula: C13H10ClNO4 MolecularWeight: 279.6758

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC2=C(C(=C1)Cl)OCCO2)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CC2=C(C(=C1)Cl)OCCO2)/C#N

InChI

InChI=1S/C13H10ClNO4/c1-17-13(16)9(7-15)4-8-5-10(14)12-11(6-8)18-2-3-19-12/h4-6H,2-3H2,1H3/b9-4+