tert-butyl N-[4-chloranyl-2-(1-oxidanyl-4-phenylmethoxy-butyl)phenyl]carbamate

Systemtic Name: tert-butyl N-[4-chloranyl-2-(1-oxidanyl-4-phenylmethoxy-butyl)phenyl]carbamate Openeye Name: tert-butyl N-[2-(4-benzyloxy-1-hydroxy-butyl)-4-chloro-phenyl]carbamate CAS Name: N-[4-chloro-2-(1-hydroxy-4-phenylmethoxybutyl)phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-chloro-2-(1-hydroxy-4-phenylmethoxybutyl)phenyl]carbamate Traditional Name: N-[2-(4-benzoxy-1-hydroxy-butyl)-4-chloro-phenyl]carbamic acid tert-butyl ester Formula: C22H28ClNO4 MolecularWeight: 405.91502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)Cl)C(CCCOCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)Cl)C(CCCOCC2=CC=CC=C2)O

InChI

InChI=1S/C22H28ClNO4/c1-22(2,3)28-21(26)24-19-12-11-17(23)14-18(19)20(25)10-7-13-27-15-16-8-5-4-6-9-16/h4-6,8-9,11-12,14,20,25H,7,10,13,15H2,1-3H3,(H,24,26)