2-[1-(4-cyclopropylcarbonylphenyl)propyl]propanedioic acid

Systemtic Name: 2-[1-(4-cyclopropylcarbonylphenyl)propyl]propanedioic acid Openeye Name: 2-[1-[4-(cyclopropanecarbonyl)phenyl]propyl]propanedioic acid CAS Name: 2-[1-[4-[cyclopropyl(oxo)methyl]phenyl]propyl]propanedioic acid IUPAC Name: 2-[1-[4-(cyclopropanecarbonyl)phenyl]propyl]propanedioic acid Traditional Name: 2-[1-[4-(cyclopropanecarbonyl)phenyl]propyl]malonic acid Formula: C16H18O5 MolecularWeight: 290.31112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C(=O)C2CC2)C(C(=O)O)C(=O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)C(=O)C2CC2)C(C(=O)O)C(=O)O

InChI

InChI=1S/C16H18O5/c1-2-12(13(15(18)19)16(20)21)9-3-5-10(6-4-9)14(17)11-7-8-11/h3-6,11-13H,2,7-8H2,1H3,(H,18,19)(H,20,21)