(E)-4-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-2-methyl-but-2-enoate

Systemtic Name: (E)-4-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-2-methyl-but-2-enoate Openeye Name: (E)-4-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-2-methyl-but-2-enoate CAS Name: (E)-4-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-2-methyl-2-butenoate IUPAC Name: (E)-4-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-2-methylbut-2-enoate Traditional Name: (E)-4-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-2-methyl-but-2-enoate Formula: C21H21O6- MolecularWeight: 369.38784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=CC=C(C=C1)CCC2=CC3=C(C(=C2)OC)OCO3)C(=O)[O-]

Isomeric SMILES

C/C(=C\COC1=CC=C(C=C1)CCC2=CC3=C(C(=C2)OC)OCO3)/C(=O)[O-]

InChI

InChI=1S/C21H22O6/c1-14(21(22)23)9-10-25-17-7-5-15(6-8-17)3-4-16-11-18(24-2)20-19(12-16)26-13-27-20/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,22,23)/p-1/b14-9+