(4-chlorophenyl)methyl 1-(1-hydroxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 1-(1-hydroxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylate Openeye Name: (4-chlorophenyl)methyl 1-(1-hydroxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylate CAS Name: 1-(1-hydroxyethyl)-4-phenyl-1-cyclohexa-2,5-dienecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 1-(1-hydroxyethyl)-4-phenylcyclohexa-2,5-diene-1-carboxylate Traditional Name: 1-(1-hydroxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid (4-chlorobenzyl) ester Formula: C22H21ClO3 MolecularWeight: 368.85334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(C=CC(C=C1)C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(C1(C=CC(C=C1)C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H21ClO3/c1-16(24)22(21(25)26-15-17-7-9-20(23)10-8-17)13-11-19(12-14-22)18-5-3-2-4-6-18/h2-14,16,19,24H,15H2,1H3