(phenylmethyl) (2S)-2-(1-bromanyl-2-oxidanyl-pent-4-en-2-yl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(1-bromanyl-2-oxidanyl-pent-4-en-2-yl)pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[1-(bromomethyl)-1-hydroxy-but-3-enyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-(1-bromo-2-hydroxypent-4-en-2-yl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(1-bromo-2-hydroxypent-4-en-2-yl)pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[1-(bromomethyl)-1-hydroxy-but-3-enyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C17H22BrNO3 MolecularWeight: 368.26548

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CBr)(C1CCCN1C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

C=CCC(CBr)([C@@H]1CCCN1C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C17H22BrNO3/c1-2-10-17(21,13-18)15-9-6-11-19(15)16(20)22-12-14-7-4-3-5-8-14/h2-5,7-8,15,21H,1,6,9-13H2/t15-,17?/m0/s1