4-[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-5-phenylmethoxy-phenoxy]-4-(2-methylphenyl)butanoate

Systemtic Name: 4-[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-5-phenylmethoxy-phenoxy]-4-(2-methylphenyl)butanoate Openeye Name: 4-[5-benzyloxy-2-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenoxy]-4-(o-tolyl)butanoate CAS Name: 4-[2-[(E)-3-methoxy-3-oxoprop-1-enyl]-5-phenylmethoxyphenoxy]-4-(2-methylphenyl)butanoate IUPAC Name: 4-[2-[(E)-3-methoxy-3-oxoprop-1-enyl]-5-phenylmethoxyphenoxy]-4-(2-methylphenyl)butanoate Traditional Name: 4-[5-benzoxy-2-[(E)-3-keto-3-methoxy-prop-1-enyl]phenoxy]-4-(o-tolyl)butyrate Formula: C28H27O6- MolecularWeight: 459.51038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CC=CC=C3)C=CC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CC=CC=C3)/C=C/C(=O)OC

InChI

InChI=1S/C28H28O6/c1-20-8-6-7-11-24(20)25(15-16-27(29)30)34-26-18-23(33-19-21-9-4-3-5-10-21)14-12-22(26)13-17-28(31)32-2/h3-14,17-18,25H,15-16,19H2,1-2H3,(H,29,30)/p-1/b17-13+