(2S,4R)-2-azanyl-4-[(4-chlorophenyl)methyl]pentanedioic acid

Systemtic Name: (2S,4R)-2-azanyl-4-[(4-chlorophenyl)methyl]pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-[(4-chlorophenyl)methyl]pentanedioic acid CAS Name: (2S,4R)-2-amino-4-[(4-chlorophenyl)methyl]pentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-[(4-chlorophenyl)methyl]pentanedioic acid Traditional Name: (2S,4R)-2-amino-4-(4-chlorobenzyl)glutaric acid Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CC(C(=O)O)N)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C[C@H](C[C@@H](C(=O)O)N)C(=O)O)Cl

InChI

InChI=1S/C12H14ClNO4/c13-9-3-1-7(2-4-9)5-8(11(15)16)6-10(14)12(17)18/h1-4,8,10H,5-6,14H2,(H,15,16)(H,17,18)/t8-,10+/m1/s1