(2S)-2-[(2-chlorophenyl)methyl]butanedioic acid

Systemtic Name: (2S)-2-[(2-chlorophenyl)methyl]butanedioic acid Openeye Name: (2S)-2-[(2-chlorophenyl)methyl]butanedioic acid CAS Name: (2S)-2-[(2-chlorophenyl)methyl]butanedioic acid IUPAC Name: (2S)-2-[(2-chlorophenyl)methyl]butanedioic acid Traditional Name: (2S)-2-(2-chlorobenzyl)succinic acid Formula: C11H11ClO4 MolecularWeight: 242.65564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C(=C1)C[C@@H](CC(=O)O)C(=O)O)Cl

InChI

InChI=1S/C11H11ClO4/c12-9-4-2-1-3-7(9)5-8(11(15)16)6-10(13)14/h1-4,8H,5-6H2,(H,13,14)(H,15,16)/t8-/m0/s1