2-[[8-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl]oxy]propanoic acid

Systemtic Name: 2-[[8-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl]oxy]propanoic acid Openeye Name: 2-[8-methyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl]oxypropanoic acid CAS Name: 2-[[8-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy]propanoic acid IUPAC Name: 2-[[8-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl]oxy]propanoic acid Traditional Name: 2-[8-methyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl]oxypropionic acid Formula: C29H48O4 MolecularWeight: 460.68902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OC(C)C(=O)O)CCC(O2)CCCC(C)CCCC(C)CCCC(C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)OC(C)C(=O)O)CCC(O2)CCCC(C)CCCC(C)CCCC(C)C

InChI

InChI=1S/C29H48O4/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-26-17-16-25-19-27(32-24(6)29(30)31)18-23(5)28(25)33-26/h18-22,24,26H,7-17H2,1-6H3,(H,30,31)