2-methylidene-3-(phenylmethyl)heptanoic acid

Systemtic Name: 2-methylidene-3-(phenylmethyl)heptanoic acid Openeye Name: 3-benzyl-2-methylene-heptanoic acid CAS Name: 2-methylene-3-(phenylmethyl)heptanoic acid IUPAC Name: 3-benzyl-2-methylideneheptanoic acid Traditional Name: 2-(1-benzylpentyl)acrylic acid Formula: C15H20O2 MolecularWeight: 232.3181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CC=C1)C(=C)C(=O)O

Isomeric SMILES

CCCCC(CC1=CC=CC=C1)C(=C)C(=O)O

InChI

InChI=1S/C15H20O2/c1-3-4-10-14(12(2)15(16)17)11-13-8-6-5-7-9-13/h5-9,14H,2-4,10-11H2,1H3,(H,16,17)