(4-tert-butylphenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate

Systemtic Name: (4-tert-butylphenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate Openeye Name: (4-tert-butylphenyl) (E)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propenoic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isoamoxy-3-methoxy-phenyl)acrylic acid (4-tert-butylphenyl) ester Formula: C25H32O4 MolecularWeight: 396.51918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32O4/c1-18(2)15-16-28-22-13-7-19(17-23(22)27-6)8-14-24(26)29-21-11-9-20(10-12-21)25(3,4)5/h7-14,17-18H,15-16H2,1-6H3/b14-8+