4-(2-hydroxyphenyl)-4-(4-methylphenyl)carbonyloxy-cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: 4-(2-hydroxyphenyl)-4-(4-methylphenyl)carbonyloxy-cyclohexa-2,5-diene-1-carboxylate Openeye Name: 4-(2-hydroxyphenyl)-4-(4-methylbenzoyl)oxy-cyclohexa-2,5-diene-1-carboxylate CAS Name: 4-(2-hydroxyphenyl)-4-[(4-methylphenyl)-oxomethoxy]-1-cyclohexa-2,5-dienecarboxylate IUPAC Name: 4-(2-hydroxyphenyl)-4-(4-methylbenzoyl)oxycyclohexa-2,5-diene-1-carboxylate Traditional Name: 4-(2-hydroxyphenyl)-4-p-toluoyloxy-cyclohexa-2,5-diene-1-carboxylate Formula: C21H17O5- MolecularWeight: 349.35668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C(=O)[O-])C3=CC=CC=C3O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C(=O)[O-])C3=CC=CC=C3O

InChI

InChI=1S/C21H18O5/c1-14-6-8-16(9-7-14)20(25)26-21(17-4-2-3-5-18(17)22)12-10-15(11-13-21)19(23)24/h2-13,15,22H,1H3,(H,23,24)/p-1