(2R,4S)-2-azanyl-4-[(3-bromophenyl)methyl]pentanedioic acid

Systemtic Name: (2R,4S)-2-azanyl-4-[(3-bromophenyl)methyl]pentanedioic acid Openeye Name: (2R,4S)-2-amino-4-[(3-bromophenyl)methyl]pentanedioic acid CAS Name: (2R,4S)-2-amino-4-[(3-bromophenyl)methyl]pentanedioic acid IUPAC Name: (2R,4S)-2-amino-4-[(3-bromophenyl)methyl]pentanedioic acid Traditional Name: (2R,4S)-2-amino-4-(3-bromobenzyl)glutaric acid Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO4/c13-9-3-1-2-7(5-9)4-8(11(15)16)6-10(14)12(17)18/h1-3,5,8,10H,4,6,14H2,(H,15,16)(H,17,18)/t8-,10+/m0/s1