(E)-3-(4-heptylphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-heptylphenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-heptylphenyl)prop-2-enoic acid CAS Name: (E)-3-(4-heptylphenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-heptylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-heptylphenyl)acrylic acid Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)/C=C/C(=O)O

InChI

InChI=1S/C16H22O2/c1-2-3-4-5-6-7-14-8-10-15(11-9-14)12-13-16(17)18/h8-13H,2-7H2,1H3,(H,17,18)/b13-12+