tert-butyl N-(1-oxidanyl-5,6-diphenyl-hexan-2-yl)carbamate; 2-methyl-3-oxidanyl-benzamide

Systemtic Name: tert-butyl N-(1-oxidanyl-5,6-diphenyl-hexan-2-yl)carbamate; 2-methyl-3-oxidanyl-benzamide Openeye Name: tert-butyl N-[1-(hydroxymethyl)-4,5-diphenyl-pentyl]carbamate; 3-hydroxy-2-methyl-benzamide CAS Name: N-(1-hydroxy-5,6-diphenylhexan-2-yl)carbamic acid tert-butyl ester; 3-hydroxy-2-methylbenzamide IUPAC Name: tert-butyl N-(1-hydroxy-5,6-diphenylhexan-2-yl)carbamate; 3-hydroxy-2-methylbenzamide Traditional Name: 3-hydroxy-2-methyl-benzamide; N-(1-methylol-4,5-diphenyl-pentyl)carbamic acid tert-butyl ester Formula: C31H40N2O5 MolecularWeight: 520.6597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)N.CC(C)(C)OC(=O)NC(CCC(CC1=CC=CC=C1)C2=CC=CC=C2)CO

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)N.CC(C)(C)OC(=O)NC(CCC(CC1=CC=CC=C1)C2=CC=CC=C2)CO

InChI

InChI=1S/C23H31NO3.C8H9NO2/c1-23(2,3)27-22(26)24-21(17-25)15-14-20(19-12-8-5-9-13-19)16-18-10-6-4-7-11-18;1-5-6(8(9)11)3-2-4-7(5)10/h4-13,20-21,25H,14-17H2,1-3H3,(H,24,26);2-4,10H,1H3,(H2,9,11)