O4-tert-butyl O3-(phenylmethyl) 7-ethenyl-2-(phenylseleninylmethyl)-1,3-oxazepane-3,4-dicarboxylate

Systemtic Name: O4-tert-butyl O3-(phenylmethyl) 7-ethenyl-2-(phenylseleninylmethyl)-1,3-oxazepane-3,4-dicarboxylate Openeye Name: O3-benzyl O4-tert-butyl 2-(phenylseleninylmethyl)-7-vinyl-1,3-oxazepane-3,4-dicarboxylate CAS Name: 7-ethenyl-2-(phenylseleninylmethyl)-1,3-oxazepane-3,4-dicarboxylic acid O4-tert-butyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 4-O-tert-butyl 7-ethenyl-2-(phenylseleninylmethyl)-1,3-oxazepane-3,4-dicarboxylate Traditional Name: 2-(phenylseleninylmethyl)-7-vinyl-1,3-oxazepane-3,4-dicarboxylic acid O3-benzyl ester O4-tert-butyl ester Formula: C27H33NO6Se MolecularWeight: 546.51402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC(OC(N1C(=O)OCC2=CC=CC=C2)C[Se](=O)C3=CC=CC=C3)C=C

Isomeric SMILES

CC(C)(C)OC(=O)C1CCC(OC(N1C(=O)OCC2=CC=CC=C2)C[Se](=O)C3=CC=CC=C3)C=C

InChI

InChI=1S/C27H33NO6Se/c1-5-21-16-17-23(25(29)34-27(2,3)4)28(26(30)32-18-20-12-8-6-9-13-20)24(33-21)19-35(31)22-14-10-7-11-15-22/h5-15,21,23-24H,1,16-19H2,2-4H3