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

Systemtic Name: (4-chloranyl-3-methyl-phenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate Openeye Name: (4-chloro-3-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 (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isoamoxy-3-methoxy-phenyl)acrylic acid (4-chloro-3-methyl-phenyl) ester Formula: C22H25ClO4 MolecularWeight: 388.8845

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClO4/c1-15(2)11-12-26-20-9-5-17(14-21(20)25-4)6-10-22(24)27-18-7-8-19(23)16(3)13-18/h5-10,13-15H,11-12H2,1-4H3/b10-6+