(phenylmethyl) N-[4-(4-octylphenyl)-1-oxidanyl-2-(phenylmethoxymethyl)butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[4-(4-octylphenyl)-1-oxidanyl-2-(phenylmethoxymethyl)butan-2-yl]carbamate Openeye Name: benzyl N-[1-(benzyloxymethyl)-1-(hydroxymethyl)-3-(4-octylphenyl)propyl]carbamate CAS Name: N-[1-hydroxy-4-(4-octylphenyl)-2-(phenylmethoxymethyl)butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-hydroxy-4-(4-octylphenyl)-2-(phenylmethoxymethyl)butan-2-yl]carbamate Traditional Name: N-[1-(benzoxymethyl)-1-methylol-3-(4-octylphenyl)propyl]carbamic acid benzyl ester Formula: C34H45NO4 MolecularWeight: 531.7254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CO)(COCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CO)(COCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C34H45NO4/c1-2-3-4-5-6-9-14-29-19-21-30(22-20-29)23-24-34(27-36,28-38-25-31-15-10-7-11-16-31)35-33(37)39-26-32-17-12-8-13-18-32/h7-8,10-13,15-22,36H,2-6,9,14,23-28H2,1H3,(H,35,37)