7-[2,2-dimethyl-5-(2-methylphenyl)-1,3-dioxan-4-yl]heptanoic acid

Systemtic Name: 7-[2,2-dimethyl-5-(2-methylphenyl)-1,3-dioxan-4-yl]heptanoic acid Openeye Name: 7-[2,2-dimethyl-5-(o-tolyl)-1,3-dioxan-4-yl]heptanoic acid CAS Name: 7-[2,2-dimethyl-5-(2-methylphenyl)-1,3-dioxan-4-yl]heptanoic acid IUPAC Name: 7-[2,2-dimethyl-5-(2-methylphenyl)-1,3-dioxan-4-yl]heptanoic acid Traditional Name: 7-[2,2-dimethyl-5-(o-tolyl)-1,3-dioxan-4-yl]enanthic acid Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2COC(OC2CCCCCCC(=O)O)(C)C

Isomeric SMILES

CC1=CC=CC=C1C2COC(OC2CCCCCCC(=O)O)(C)C

InChI

InChI=1S/C20H30O4/c1-15-10-8-9-11-16(15)17-14-23-20(2,3)24-18(17)12-6-4-5-7-13-19(21)22/h8-11,17-18H,4-7,12-14H2,1-3H3,(H,21,22)