4-(hydroxymethyl)-2-phenethyl-heptanoic acid

Systemtic Name: 4-(hydroxymethyl)-2-phenethyl-heptanoic acid Openeye Name: 4-(hydroxymethyl)-2-phenethyl-heptanoic acid CAS Name: 4-(hydroxymethyl)-2-phenethylheptanoic acid IUPAC Name: 4-(hydroxymethyl)-2-phenethylheptanoic acid Traditional Name: 4-methylol-2-phenethyl-enanthic acid Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(CCC1=CC=CC=C1)C(=O)O)CO

Isomeric SMILES

CCCC(CC(CCC1=CC=CC=C1)C(=O)O)CO

InChI

InChI=1S/C16H24O3/c1-2-6-14(12-17)11-15(16(18)19)10-9-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,2,6,9-12H2,1H3,(H,18,19)