2-methylpropyl 3-(2-chloroethyl)-4-methyl-6-oxidanyl-2-phenyl-benzoate

Systemtic Name: 2-methylpropyl 3-(2-chloroethyl)-4-methyl-6-oxidanyl-2-phenyl-benzoate Openeye Name: isobutyl 3-(2-chloroethyl)-6-hydroxy-4-methyl-2-phenyl-benzoate CAS Name: 3-(2-chloroethyl)-6-hydroxy-4-methyl-2-phenylbenzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(2-chloroethyl)-6-hydroxy-4-methyl-2-phenylbenzoate Traditional Name: 3-(2-chloroethyl)-6-hydroxy-4-methyl-2-phenyl-benzoic acid isobutyl ester Formula: C20H23ClO3 MolecularWeight: 346.84782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CCCl)C2=CC=CC=C2)C(=O)OCC(C)C)O

Isomeric SMILES

CC1=CC(=C(C(=C1CCCl)C2=CC=CC=C2)C(=O)OCC(C)C)O

InChI

InChI=1S/C20H23ClO3/c1-13(2)12-24-20(23)19-17(22)11-14(3)16(9-10-21)18(19)15-7-5-4-6-8-15/h4-8,11,13,22H,9-10,12H2,1-3H3