ethyl 2-(4-heptoxyphenyl)-4-oxidanyl-butanoate

Systemtic Name: ethyl 2-(4-heptoxyphenyl)-4-oxidanyl-butanoate Openeye Name: ethyl 2-(4-heptoxyphenyl)-4-hydroxy-butanoate CAS Name: 2-(4-heptoxyphenyl)-4-hydroxybutanoic acid ethyl ester IUPAC Name: ethyl 2-(4-heptoxyphenyl)-4-hydroxybutanoate Traditional Name: 2-(4-heptoxyphenyl)-4-hydroxy-butyric acid ethyl ester Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(CCO)C(=O)OCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(CCO)C(=O)OCC

InChI

InChI=1S/C19H30O4/c1-3-5-6-7-8-15-23-17-11-9-16(10-12-17)18(13-14-20)19(21)22-4-2/h9-12,18,20H,3-8,13-15H2,1-2H3