3-butyl-5-(4-heptylphenyl)oxolan-2-one

Systemtic Name: 3-butyl-5-(4-heptylphenyl)oxolan-2-one Openeye Name: 3-butyl-5-(4-heptylphenyl)tetrahydrofuran-2-one CAS Name: 3-butyl-5-(4-heptylphenyl)-2-oxolanone IUPAC Name: 3-butyl-5-(4-heptylphenyl)oxolan-2-one Traditional Name: 3-butyl-5-(4-heptylphenyl)tetrahydrofuran-2-one Formula: C21H32O2 MolecularWeight: 316.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2CC(C(=O)O2)CCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2CC(C(=O)O2)CCCC

InChI

InChI=1S/C21H32O2/c1-3-5-7-8-9-10-17-12-14-18(15-13-17)20-16-19(11-6-4-2)21(22)23-20/h12-15,19-20H,3-11,16H2,1-2H3