(phenylmethyl) N-[3-(3,5-dimethyl-4-oxidanyl-phenyl)propyl]-N-(2-phenylseleninylethyl)carbamate

Systemtic Name: (phenylmethyl) N-[3-(3,5-dimethyl-4-oxidanyl-phenyl)propyl]-N-(2-phenylseleninylethyl)carbamate Openeye Name: benzyl N-[3-(4-hydroxy-3,5-dimethyl-phenyl)propyl]-N-(2-phenylseleninylethyl)carbamate CAS Name: N-[3-(4-hydroxy-3,5-dimethylphenyl)propyl]-N-(2-phenylseleninylethyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(4-hydroxy-3,5-dimethylphenyl)propyl]-N-(2-phenylseleninylethyl)carbamate Traditional Name: N-[3-(4-hydroxy-3,5-dimethyl-phenyl)propyl]-N-(2-phenylseleninylethyl)carbamic acid benzyl ester Formula: C27H31NO4Se MolecularWeight: 512.49934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CCCN(CC[Se](=O)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CCCN(CC[Se](=O)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H31NO4Se/c1-21-18-24(19-22(2)26(21)29)12-9-15-28(16-17-33(31)25-13-7-4-8-14-25)27(30)32-20-23-10-5-3-6-11-23/h3-8,10-11,13-14,18-19,29H,9,12,15-17,20H2,1-2H3