2-butoxy-7-(hydroxymethyl)-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-butoxy-7-(hydroxymethyl)-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-butoxy-7-(hydroxymethyl)-4-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-butoxy-7-(hydroxymethyl)-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-butoxy-7-(hydroxymethyl)-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-butoxy-4-isopropyl-7-methylol-cyclohepta-2,4,6-trien-1-one Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC=C(C1=O)CO)C(C)C

Isomeric SMILES

CCCCOC1=CC(=CC=C(C1=O)CO)C(C)C

InChI

InChI=1S/C15H22O3/c1-4-5-8-18-14-9-12(11(2)3)6-7-13(10-16)15(14)17/h6-7,9,11,16H,4-5,8,10H2,1-3H3