2-oxidanylidenepropyl (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: 2-oxidanylidenepropyl (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: acetonyl (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]-3-methylbutanoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl (2S)-2-[(4-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butyric acid acetonyl ester Formula: C15H18BrNO4 MolecularWeight: 356.21172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C)NC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C15H18BrNO4/c1-9(2)13(15(20)21-8-10(3)18)17-14(19)11-4-6-12(16)7-5-11/h4-7,9,13H,8H2,1-3H3,(H,17,19)/t13-/m0/s1