(5-phenylmethoxy-5,6,7,8-tetrahydronaphthalen-2-yl) 2-azanyl-4-oxidanyl-2-[3-(2-phenylmethoxyethyl)phenyl]butaneperoxoate

Systemtic Name: (5-phenylmethoxy-5,6,7,8-tetrahydronaphthalen-2-yl) 2-azanyl-4-oxidanyl-2-[3-(2-phenylmethoxyethyl)phenyl]butaneperoxoate Openeye Name: (1-benzyloxytetralin-6-yl) 2-amino-2-[3-(2-benzyloxyethyl)phenyl]-4-hydroxy-butaneperoxoate CAS Name: 2-amino-4-hydroxy-2-[3-(2-phenylmethoxyethyl)phenyl]butaneperoxoic acid (5-phenylmethoxy-5,6,7,8-tetrahydronaphthalen-2-yl) ester IUPAC Name: (5-phenylmethoxy-5,6,7,8-tetrahydronaphthalen-2-yl) 2-amino-4-hydroxy-2-[3-(2-phenylmethoxyethyl)phenyl]butaneperoxoate Traditional Name: 2-amino-2-[3-(2-benzoxyethyl)phenyl]-4-hydroxy-peroxybutyric acid (1-benzoxytetralin-6-yl) ester Formula: C36H39NO6 MolecularWeight: 581.69796

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C=C(C=C2)OOC(=O)C(CCO)(C3=CC=CC(=C3)CCOCC4=CC=CC=C4)N)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(C2=C(C1)C=C(C=C2)OOC(=O)C(CCO)(C3=CC=CC(=C3)CCOCC4=CC=CC=C4)N)OCC5=CC=CC=C5

InChI

InChI=1S/C36H39NO6/c37-36(20-21-38,31-15-7-13-27(23-31)19-22-40-25-28-9-3-1-4-10-28)35(39)43-42-32-17-18-33-30(24-32)14-8-16-34(33)41-26-29-11-5-2-6-12-29/h1-7,9-13,15,17-18,23-24,34,38H,8,14,16,19-22,25-26,37H2