(2-bromanyl-4-methyl-phenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate Openeye Name: (2-bromo-4-methyl-phenyl) (E)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propenoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isoamoxy-3-methoxy-phenyl)acrylic acid (2-bromo-4-methyl-phenyl) ester Formula: C22H25BrO4 MolecularWeight: 433.3355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C=CC2=CC(=C(C=C2)OCCC(C)C)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)/C=C/C2=CC(=C(C=C2)OCCC(C)C)OC)Br

InChI

InChI=1S/C22H25BrO4/c1-15(2)11-12-26-20-9-6-17(14-21(20)25-4)7-10-22(24)27-19-8-5-16(3)13-18(19)23/h5-10,13-15H,11-12H2,1-4H3/b10-7+