3-oxidanylpropyl 4-(4-methoxyphenyl)-2,2-dimethyl-hexanoate

Systemtic Name: 3-oxidanylpropyl 4-(4-methoxyphenyl)-2,2-dimethyl-hexanoate Openeye Name: 3-hydroxypropyl 4-(4-methoxyphenyl)-2,2-dimethyl-hexanoate CAS Name: 4-(4-methoxyphenyl)-2,2-dimethylhexanoic acid 3-hydroxypropyl ester IUPAC Name: 3-hydroxypropyl 4-(4-methoxyphenyl)-2,2-dimethylhexanoate Traditional Name: 4-(4-methoxyphenyl)-2,2-dimethyl-hexanoic acid 3-hydroxypropyl ester Formula: C18H28O4 MolecularWeight: 308.41252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(C)C(=O)OCCCO)C1=CC=C(C=C1)OC

Isomeric SMILES

CCC(CC(C)(C)C(=O)OCCCO)C1=CC=C(C=C1)OC

InChI

InChI=1S/C18H28O4/c1-5-14(15-7-9-16(21-4)10-8-15)13-18(2,3)17(20)22-12-6-11-19/h7-10,14,19H,5-6,11-13H2,1-4H3