(3S,4R,5S)-5-azido-4-(bromomethyl)-1-cyclohexyl-4-methyl-3-phenylmethoxy-pyrrolidin-2-one

Systemtic Name: (3S,4R,5S)-5-azido-4-(bromomethyl)-1-cyclohexyl-4-methyl-3-phenylmethoxy-pyrrolidin-2-one Openeye Name: (3S,4R,5S)-5-azido-3-benzyloxy-4-(bromomethyl)-1-cyclohexyl-4-methyl-pyrrolidin-2-one CAS Name: (3S,4R,5S)-5-azido-4-(bromomethyl)-1-cyclohexyl-4-methyl-3-phenylmethoxy-2-pyrrolidinone IUPAC Name: (3S,4R,5S)-5-azido-4-(bromomethyl)-1-cyclohexyl-4-methyl-3-phenylmethoxypyrrolidin-2-one Traditional Name: (3S,4R,5S)-5-azido-3-benzoxy-4-(bromomethyl)-1-cyclohexyl-4-methyl-2-pyrrolidone Formula: C19H25BrN4O2 MolecularWeight: 421.3314

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)N(C1N=[N+]=[N-])C2CCCCC2)OCC3=CC=CC=C3)CBr

Isomeric SMILES

C[C@@]1([C@@H](C(=O)N([C@H]1N=[N+]=[N-])C2CCCCC2)OCC3=CC=CC=C3)CBr

InChI

InChI=1S/C19H25BrN4O2/c1-19(13-20)16(26-12-14-8-4-2-5-9-14)17(25)24(18(19)22-23-21)15-10-6-3-7-11-15/h2,4-5,8-9,15-16,18H,3,6-7,10-13H2,1H3/t16-,18-,19+/m1/s1