(4-propan-2-ylphenyl)methyl (E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: (4-propan-2-ylphenyl)methyl (E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoate Openeye Name: (4-isopropylphenyl)methyl (E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-2-propenoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl (E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)acrylic acid (4-isopropylbenzyl) ester Formula: C22H25ClO4 MolecularWeight: 388.8845

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)OCC2=CC=C(C=C2)C(C)C)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)OCC2=CC=C(C=C2)C(C)C)Cl)OC

InChI

InChI=1S/C22H25ClO4/c1-5-26-20-13-17(12-19(23)22(20)25-4)8-11-21(24)27-14-16-6-9-18(10-7-16)15(2)3/h6-13,15H,5,14H2,1-4H3/b11-8+