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

Systemtic Name: 3-butyl-5-(4-heptoxyphenyl)oxolan-2-one Openeye Name: 3-butyl-5-(4-heptoxyphenyl)tetrahydrofuran-2-one CAS Name: 3-butyl-5-(4-heptoxyphenyl)-2-oxolanone IUPAC Name: 3-butyl-5-(4-heptoxyphenyl)oxolan-2-one Traditional Name: 3-butyl-5-(4-heptoxyphenyl)tetrahydrofuran-2-one Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2CC(C(=O)O2)CCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2CC(C(=O)O2)CCCC

InChI

InChI=1S/C21H32O3/c1-3-5-7-8-9-15-23-19-13-11-17(12-14-19)20-16-18(10-6-4-2)21(22)24-20/h11-14,18,20H,3-10,15-16H2,1-2H3