methyl 4-[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]oxybenzoate

Systemtic Name: methyl 4-[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]oxybenzoate Openeye Name: methyl 4-[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-enoyl]oxybenzoate CAS Name: 4-[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]oxybenzoate Traditional Name: 4-[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)acryloyl]oxybenzoic acid methyl ester Formula: C21H21ClO6 MolecularWeight: 404.84084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=CC(=O)OC2=CC=C(C=C2)C(=O)OC)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C/C(=O)OC2=CC=C(C=C2)C(=O)OC)OC

InChI

InChI=1S/C21H21ClO6/c1-13(2)27-20-17(22)11-14(12-18(20)25-3)5-10-19(23)28-16-8-6-15(7-9-16)21(24)26-4/h5-13H,1-4H3/b10-5+