2-[7-(4-chlorophenyl)heptyl]propanedioic acid

Systemtic Name: 2-[7-(4-chlorophenyl)heptyl]propanedioic acid Openeye Name: 2-[7-(4-chlorophenyl)heptyl]propanedioic acid CAS Name: 2-[7-(4-chlorophenyl)heptyl]propanedioic acid IUPAC Name: 2-[7-(4-chlorophenyl)heptyl]propanedioic acid Traditional Name: 2-[7-(4-chlorophenyl)heptyl]malonic acid Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCCCC(C(=O)O)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CCCCCCCC(C(=O)O)C(=O)O)Cl

InChI

InChI=1S/C16H21ClO4/c17-13-10-8-12(9-11-13)6-4-2-1-3-5-7-14(15(18)19)16(20)21/h8-11,14H,1-7H2,(H,18,19)(H,20,21)