3-[2-[(2-methanoylcyclohexen-1-yl)methyl]phenyl]propanoic acid

Systemtic Name: 3-[2-[(2-methanoylcyclohexen-1-yl)methyl]phenyl]propanoic acid Openeye Name: 3-[2-[(2-formylcyclohexen-1-yl)methyl]phenyl]propanoic acid CAS Name: 3-[2-[(2-formyl-1-cyclohexenyl)methyl]phenyl]propanoic acid IUPAC Name: 3-[2-[(2-formylcyclohexen-1-yl)methyl]phenyl]propanoic acid Traditional Name: 3-[2-[(2-formylcyclohexen-1-yl)methyl]phenyl]propionic acid Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)CC2=CC=CC=C2CCC(=O)O)C=O

Isomeric SMILES

C1CCC(=C(C1)CC2=CC=CC=C2CCC(=O)O)C=O

InChI

InChI=1S/C17H20O3/c18-12-16-8-4-3-7-15(16)11-14-6-2-1-5-13(14)9-10-17(19)20/h1-2,5-6,12H,3-4,7-11H2,(H,19,20)