1-methyl-3-nonyl-benzene; 6-oxidanylhexanoic acid

Systemtic Name: 1-methyl-3-nonyl-benzene; 6-oxidanylhexanoic acid Openeye Name: 6-hydroxyhexanoic acid; 1-methyl-3-nonyl-benzene CAS Name: 6-hydroxyhexanoic acid; 1-methyl-3-nonylbenzene IUPAC Name: 6-hydroxyhexanoic acid; 1-methyl-3-nonylbenzene Traditional Name: 6-hydroxyhexanoic acid; 1-methyl-3-nonyl-benzene Formula: C22H38O3 MolecularWeight: 350.53532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC(=C1)C.C(CCC(=O)O)CCO

Isomeric SMILES

CCCCCCCCCC1=CC=CC(=C1)C.C(CCC(=O)O)CCO

InChI

InChI=1S/C16H26.C6H12O3/c1-3-4-5-6-7-8-9-12-16-13-10-11-15(2)14-16;7-5-3-1-2-4-6(8)9/h10-11,13-14H,3-9,12H2,1-2H3;7H,1-5H2,(H,8,9)