4-(4-methyl-5-octyl-1,3-dioxan-2-yl)benzoic acid

Systemtic Name: 4-(4-methyl-5-octyl-1,3-dioxan-2-yl)benzoic acid Openeye Name: 4-(4-methyl-5-octyl-1,3-dioxan-2-yl)benzoic acid CAS Name: 4-(4-methyl-5-octyl-1,3-dioxan-2-yl)benzoic acid IUPAC Name: 4-(4-methyl-5-octyl-1,3-dioxan-2-yl)benzoic acid Traditional Name: 4-(4-methyl-5-octyl-1,3-dioxan-2-yl)benzoic acid Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1COC(OC1C)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCC1COC(OC1C)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H30O4/c1-3-4-5-6-7-8-9-18-14-23-20(24-15(18)2)17-12-10-16(11-13-17)19(21)22/h10-13,15,18,20H,3-9,14H2,1-2H3,(H,21,22)