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

Systemtic Name: butyl (E)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enoate Openeye Name: butyl (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 butyl ester IUPAC Name: butyl (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 butyl ester Formula: C16H16ClNO4 MolecularWeight: 321.75554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO4/c1-2-3-4-22-16(19)12(10-18)7-11-8-13(17)15-14(9-11)20-5-6-21-15/h7-9H,2-6H2,1H3/b12-7+