methyl N-[3-(2-hydroxyethyl)-1-(4-octylphenyl)-6-oxidanyl-hexan-3-yl]carbamate

Systemtic Name: methyl N-[3-(2-hydroxyethyl)-1-(4-octylphenyl)-6-oxidanyl-hexan-3-yl]carbamate Openeye Name: methyl N-[4-hydroxy-1-(2-hydroxyethyl)-1-[2-(4-octylphenyl)ethyl]butyl]carbamate CAS Name: N-[1,6-dihydroxy-3-[2-(4-octylphenyl)ethyl]hexan-3-yl]carbamic acid methyl ester IUPAC Name: methyl N-[1,6-dihydroxy-3-[2-(4-octylphenyl)ethyl]hexan-3-yl]carbamate Traditional Name: N-[4-hydroxy-1-(2-hydroxyethyl)-1-[2-(4-octylphenyl)ethyl]butyl]carbamic acid methyl ester Formula: C24H41NO4 MolecularWeight: 407.58664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CCCO)(CCO)NC(=O)OC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CCCO)(CCO)NC(=O)OC

InChI

InChI=1S/C24H41NO4/c1-3-4-5-6-7-8-10-21-11-13-22(14-12-21)15-17-24(18-20-27,16-9-19-26)25-23(28)29-2/h11-14,26-27H,3-10,15-20H2,1-2H3,(H,25,28)