(2S)-2-[(2-bromophenyl)methylcarbamoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(2-bromophenyl)methylcarbamoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(2-bromophenyl)methylcarbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[(2-bromophenyl)methylamino]-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(2-bromophenyl)methylcarbamoylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(2-bromobenzyl)carbamoylamino]-4-methyl-valerate Formula: C14H18BrN2O3- MolecularWeight: 342.20832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)NCC1=CC=CC=C1Br

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)NCC1=CC=CC=C1Br

InChI

InChI=1S/C14H19BrN2O3/c1-9(2)7-12(13(18)19)17-14(20)16-8-10-5-3-4-6-11(10)15/h3-6,9,12H,7-8H2,1-2H3,(H,18,19)(H2,16,17,20)/p-1/t12-/m0/s1