(phenylmethyl) 4-[(E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoyl]oxybenzoate

Systemtic Name: (phenylmethyl) 4-[(E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoyl]oxybenzoate Openeye Name: benzyl 4-[(E)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enoyl]oxybenzoate CAS Name: 4-[(E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-oxoprop-2-enoxy]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoyl]oxybenzoate Traditional Name: 4-[(E)-3-(4-isoamoxy-3-methoxy-phenyl)acryloyl]oxybenzoic acid benzyl ester Formula: C29H30O6 MolecularWeight: 474.5449

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C29H30O6/c1-21(2)17-18-33-26-15-9-22(19-27(26)32-3)10-16-28(30)35-25-13-11-24(12-14-25)29(31)34-20-23-7-5-4-6-8-23/h4-16,19,21H,17-18,20H2,1-3H3/b16-10+