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2-phenylhexanoic acid; 3-phenylhexanoic acid

2-phenylhexanoic acid; 3-phenylhexanoic acid

Systemtic Name:2-phenylhexanoic acid; 3-phenylhexanoic acid
Openeye Name:2-phenylhexanoic acid; 3-phenylhexanoic acid
CAS Name:2-phenylhexanoic acid; 3-phenylhexanoic acid
IUPAC Name:2-phenylhexanoic acid; 3-phenylhexanoic acid
Traditional Name:2-phenylhexanoic acid; 3-phenylhexanoic acid
Formula: C24H32O4
MolecularWeight: 384.50848
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)C(=O)O.CCCC(CC(=O)O)C1=CC=CC=C1


Isomeric SMILES

CCCCC(C1=CC=CC=C1)C(=O)O.CCCC(CC(=O)O)C1=CC=CC=C1


InChI

InChI=1S/2C12H16O2/c1-2-6-11(9-12(13)14)10-7-4-3-5-8-10;1-2-3-9-11(12(13)14)10-7-5-4-6-8-10/h3-5,7-8,11H,2,6,9H2,1H3,(H,13,14);4-8,11H,2-3,9H2,1H3,(H,13,14)


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