(3S)-1-[(3-bromophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[(3-bromophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[(3-bromophenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(3-bromophenyl)methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[(3-bromophenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3-bromobenzyl)-5-keto-pyrrolidine-3-carboxylate Formula: C12H11BrNO3- MolecularWeight: 297.12464

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC(=CC=C2)Br)C(=O)[O-]

Isomeric SMILES

C1[C@@H](CN(C1=O)CC2=CC(=CC=C2)Br)C(=O)[O-]

InChI

InChI=1S/C12H12BrNO3/c13-10-3-1-2-8(4-10)6-14-7-9(12(16)17)5-11(14)15/h1-4,9H,5-7H2,(H,16,17)/p-1/t9-/m0/s1