1,3-benzodioxol-5-yl (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate

Systemtic Name: 1,3-benzodioxol-5-yl (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Openeye Name: 1,3-benzodioxol-5-yl (E)-3-(4-isobutoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]-2-propenoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isobutoxy-3-methoxy-phenyl)acrylic acid 1,3-benzodioxol-5-yl ester Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=CC(=O)OC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C21H22O6/c1-14(2)12-24-17-7-4-15(10-19(17)23-3)5-9-21(22)27-16-6-8-18-20(11-16)26-13-25-18/h4-11,14H,12-13H2,1-3H3/b9-5+