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

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-ethoxy-3-methoxyphenyl)-2-propenoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-ethoxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)acrylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C21H21ClO6 MolecularWeight: 404.84084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3)OC

InChI

InChI=1S/C21H21ClO6/c1-3-25-17-6-4-14(11-18(17)24-2)5-7-20(23)28-13-15-10-16(22)21-19(12-15)26-8-9-27-21/h4-7,10-12H,3,8-9,13H2,1-2H3/b7-5+