(phenylmethyl) (2S,4Z,7S)-2-methyl-8-oxidanylidene-7-phenylselanyl-2,3,6,7-tetrahydroazocine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,4Z,7S)-2-methyl-8-oxidanylidene-7-phenylselanyl-2,3,6,7-tetrahydroazocine-1-carboxylate Openeye Name: benzyl (2S,4Z,7S)-2-methyl-8-oxo-7-phenylselanyl-2,3,6,7-tetrahydroazocine-1-carboxylate CAS Name: (2S,4Z,7S)-2-methyl-8-oxo-7-(phenylseleno)-2,3,6,7-tetrahydroazocine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,4Z,7S)-2-methyl-8-oxo-7-phenylselanyl-2,3,6,7-tetrahydroazocine-1-carboxylate Traditional Name: (2S,4Z,7S)-8-keto-2-methyl-7-(phenylseleno)-2,3,6,7-tetrahydroazocine-1-carboxylic acid benzyl ester Formula: C22H23NO3Se MolecularWeight: 428.38292

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=CCC(C(=O)N1C(=O)OCC2=CC=CC=C2)[Se]C3=CC=CC=C3

Isomeric SMILES

C[C@H]1C/C=C\C[C@@H](C(=O)N1C(=O)OCC2=CC=CC=C2)[Se]C3=CC=CC=C3

InChI

InChI=1S/C22H23NO3Se/c1-17-10-8-9-15-20(27-19-13-6-3-7-14-19)21(24)23(17)22(25)26-16-18-11-4-2-5-12-18/h2-9,11-14,17,20H,10,15-16H2,1H3/b9-8-/t17-,20-/m0/s1