2,4,4-trimethylpentyl 3-(2-chloranyl-6-methoxy-phenyl)-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: 2,4,4-trimethylpentyl 3-(2-chloranyl-6-methoxy-phenyl)-3-oxidanylidene-2-phenyl-propanoate Openeye Name: 2,4,4-trimethylpentyl 3-(2-chloro-6-methoxy-phenyl)-3-oxo-2-phenyl-propanoate CAS Name: 3-(2-chloro-6-methoxyphenyl)-3-oxo-2-phenylpropanoic acid 2,4,4-trimethylpentyl ester IUPAC Name: 2,4,4-trimethylpentyl 3-(2-chloro-6-methoxyphenyl)-3-oxo-2-phenylpropanoate Traditional Name: 3-(2-chloro-6-methoxy-phenyl)-3-keto-2-phenyl-propionic acid 2,4,4-trimethylpentyl ester Formula: C24H29ClO4 MolecularWeight: 416.93766

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)C)COC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)OC

Isomeric SMILES

CC(CC(C)(C)C)COC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)OC

InChI

InChI=1S/C24H29ClO4/c1-16(14-24(2,3)4)15-29-23(27)20(17-10-7-6-8-11-17)22(26)21-18(25)12-9-13-19(21)28-5/h6-13,16,20H,14-15H2,1-5H3