(1S)-2-[(2R)-2-azanyl-4-(3-bromophenyl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]cyclopropane-1-carboxylic acid

Systemtic Name: (1S)-2-[(2R)-2-azanyl-4-(3-bromophenyl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]cyclopropane-1-carboxylic acid Openeye Name: (1S)-2-[(1R)-1-amino-3-(3-bromophenyl)-1-carboxy-propyl]cyclopropanecarboxylic acid CAS Name: (1S)-2-[(2R)-2-amino-4-(3-bromophenyl)-1-hydroxy-1-oxobutan-2-yl]-1-cyclopropanecarboxylic acid IUPAC Name: (1S)-2-[(2R)-2-amino-4-(3-bromophenyl)-1-hydroxy-1-oxobutan-2-yl]cyclopropane-1-carboxylic acid Traditional Name: (1S)-2-[(1R)-1-amino-3-(3-bromophenyl)-1-carboxy-propyl]cyclopropanecarboxylic acid Formula: C14H16BrNO4 MolecularWeight: 342.18514

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(CCC2=CC(=CC=C2)Br)(C(=O)O)N)C(=O)O

Isomeric SMILES

C1[C@@H](C1[C@](CCC2=CC(=CC=C2)Br)(C(=O)O)N)C(=O)O

InChI

InChI=1S/C14H16BrNO4/c15-9-3-1-2-8(6-9)4-5-14(16,13(19)20)11-7-10(11)12(17)18/h1-3,6,10-11H,4-5,7,16H2,(H,17,18)(H,19,20)/t10-,11?,14+/m0/s1