(2S)-2-[(3-bromophenyl)methylcarbamoylamino]pentanoic acid

Systemtic Name: (2S)-2-[(3-bromophenyl)methylcarbamoylamino]pentanoic acid Openeye Name: (2S)-2-[(3-bromophenyl)methylcarbamoylamino]pentanoic acid CAS Name: (2S)-2-[[[(3-bromophenyl)methylamino]-oxomethyl]amino]pentanoic acid IUPAC Name: (2S)-2-[(3-bromophenyl)methylcarbamoylamino]pentanoic acid Traditional Name: (2S)-2-[(3-bromobenzyl)carbamoylamino]valeric acid Formula: C13H17BrN2O3 MolecularWeight: 329.18968

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)NCC1=CC(=CC=C1)Br

Isomeric SMILES

CCC[C@@H](C(=O)O)NC(=O)NCC1=CC(=CC=C1)Br

InChI

InChI=1S/C13H17BrN2O3/c1-2-4-11(12(17)18)16-13(19)15-8-9-5-3-6-10(14)7-9/h3,5-7,11H,2,4,8H2,1H3,(H,17,18)(H2,15,16,19)/t11-/m0/s1