5-[4-(4-butoxyphenyl)phenyl]-3-heptyl-oxolan-2-one

Systemtic Name: 5-[4-(4-butoxyphenyl)phenyl]-3-heptyl-oxolan-2-one Openeye Name: 5-[4-(4-butoxyphenyl)phenyl]-3-heptyl-tetrahydrofuran-2-one CAS Name: 5-[4-(4-butoxyphenyl)phenyl]-3-heptyl-2-oxolanone IUPAC Name: 5-[4-(4-butoxyphenyl)phenyl]-3-heptyloxolan-2-one Traditional Name: 5-[4-(4-butoxyphenyl)phenyl]-3-heptyl-tetrahydrofuran-2-one Formula: C27H36O3 MolecularWeight: 408.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CC(OC1=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCCCC1CC(OC1=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C27H36O3/c1-3-5-7-8-9-10-24-20-26(30-27(24)28)23-13-11-21(12-14-23)22-15-17-25(18-16-22)29-19-6-4-2/h11-18,24,26H,3-10,19-20H2,1-2H3