tert-butyl N-[4-[2-chloranyl-3-(3-phenylmethoxyphenoxy)phenyl]-2-oxidanyl-hexan-3-yl]carbamate

Systemtic Name: tert-butyl N-[4-[2-chloranyl-3-(3-phenylmethoxyphenoxy)phenyl]-2-oxidanyl-hexan-3-yl]carbamate Openeye Name: tert-butyl N-[2-[3-(3-benzyloxyphenoxy)-2-chloro-phenyl]-1-(1-hydroxyethyl)butyl]carbamate CAS Name: N-[4-[2-chloro-3-(3-phenylmethoxyphenoxy)phenyl]-2-hydroxyhexan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-chloro-3-(3-phenylmethoxyphenoxy)phenyl]-2-hydroxyhexan-3-yl]carbamate Traditional Name: N-[2-[3-(3-benzoxyphenoxy)-2-chloro-phenyl]-1-(1-hydroxyethyl)butyl]carbamic acid tert-butyl ester Formula: C30H36ClNO5 MolecularWeight: 526.06354

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=CC=C1)OC2=CC(=CC=C2)OCC3=CC=CC=C3)Cl)C(C(C)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C1=C(C(=CC=C1)OC2=CC(=CC=C2)OCC3=CC=CC=C3)Cl)C(C(C)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H36ClNO5/c1-6-24(28(20(2)33)32-29(34)37-30(3,4)5)25-16-11-17-26(27(25)31)36-23-15-10-14-22(18-23)35-19-21-12-8-7-9-13-21/h7-18,20,24,28,33H,6,19H2,1-5H3,(H,32,34)