4-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]phenyl]butanoic acid

Systemtic Name: 4-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]phenyl]butanoic acid Openeye Name: 4-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]phenyl]butanoic acid CAS Name: 4-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]phenyl]butanoic acid IUPAC Name: 4-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]phenyl]butanoic acid Traditional Name: 4-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]phenyl]butyric acid Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CC2=CC=CC=C2CCCC(=O)O)C

Isomeric SMILES

CC1(OCC(CO1)CC2=CC=CC=C2CCCC(=O)O)C

InChI

InChI=1S/C17H24O4/c1-17(2)20-11-13(12-21-17)10-15-7-4-3-6-14(15)8-5-9-16(18)19/h3-4,6-7,13H,5,8-12H2,1-2H3,(H,18,19)