2-[4-[(E)-(2-oxidanylidenecycloheptylidene)methyl]phenyl]propanoic acid

Systemtic Name: 2-[4-[(E)-(2-oxidanylidenecycloheptylidene)methyl]phenyl]propanoic acid Openeye Name: 2-[4-[(E)-(2-oxocycloheptylidene)methyl]phenyl]propanoic acid CAS Name: 2-[4-[(E)-(2-oxocycloheptylidene)methyl]phenyl]propanoic acid IUPAC Name: 2-[4-[(E)-(2-oxocycloheptylidene)methyl]phenyl]propanoic acid Traditional Name: 2-[4-[(E)-(2-ketocycloheptylidene)methyl]phenyl]propionic acid Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C=C2CCCCCC2=O)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)/C=C/2\CCCCCC2=O)C(=O)O

InChI

InChI=1S/C17H20O3/c1-12(17(19)20)14-9-7-13(8-10-14)11-15-5-3-2-4-6-16(15)18/h7-12H,2-6H2,1H3,(H,19,20)/b15-11+