(2S)-2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-butanoate

Systemtic Name: (2S)-2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-butanoate Openeye Name: (2S)-2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-butanoate CAS Name: (2S)-2-[[[(3-bromophenyl)methylamino]-oxomethyl]amino]-2-methylbutanoate IUPAC Name: (2S)-2-[(3-bromophenyl)methylcarbamoylamino]-2-methylbutanoate Traditional Name: (2S)-2-[(3-bromobenzyl)carbamoylamino]-2-methyl-butyrate Formula: C13H16BrN2O3- MolecularWeight: 328.18174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrN2O3/c1-3-13(2,11(17)18)16-12(19)15-8-9-5-4-6-10(14)7-9/h4-7H,3,8H2,1-2H3,(H,17,18)(H2,15,16,19)/p-1/t13-/m0/s1