6-(hydroxymethyl)-6-(1-phenylethyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 6-(hydroxymethyl)-6-(1-phenylethyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: 6-(hydroxymethyl)-6-(1-phenylethyl)cyclohexa-2,4-diene-1-carboxylate CAS Name: 6-(hydroxymethyl)-6-(1-phenylethyl)-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 6-(hydroxymethyl)-6-(1-phenylethyl)cyclohexa-2,4-diene-1-carboxylate Traditional Name: 6-methylol-6-(1-phenylethyl)cyclohexa-2,4-diene-1-carboxylate Formula: C16H17O3- MolecularWeight: 257.30438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2(C=CC=CC2C(=O)[O-])CO

Isomeric SMILES

CC(C1=CC=CC=C1)C2(C=CC=CC2C(=O)[O-])CO

InChI

InChI=1S/C16H18O3/c1-12(13-7-3-2-4-8-13)16(11-17)10-6-5-9-14(16)15(18)19/h2-10,12,14,17H,11H2,1H3,(H,18,19)/p-1