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

Systemtic Name: 2-[1-(4-cyclopropylcarbonylphenyl)butyl]propanedioic acid Openeye Name: 2-[1-[4-(cyclopropanecarbonyl)phenyl]butyl]propanedioic acid CAS Name: 2-[1-[4-[cyclopropyl(oxo)methyl]phenyl]butyl]propanedioic acid IUPAC Name: 2-[1-[4-(cyclopropanecarbonyl)phenyl]butyl]propanedioic acid Traditional Name: 2-[1-[4-(cyclopropanecarbonyl)phenyl]butyl]malonic acid Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20O5/c1-2-3-13(14(16(19)20)17(21)22)10-4-6-11(7-5-10)15(18)12-8-9-12/h4-7,12-14H,2-3,8-9H2,1H3,(H,19,20)(H,21,22)