tert-butyl N-[4-ethoxy-3-(ethoxymethyl)-1-(4-hexylphenyl)-3-oxidanyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-ethoxy-3-(ethoxymethyl)-1-(4-hexylphenyl)-3-oxidanyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[3-ethoxy-2-(ethoxymethyl)-1-[(4-hexylphenyl)methyl]-2-hydroxy-propyl]carbamate CAS Name: N-[4-ethoxy-3-(ethoxymethyl)-1-(4-hexylphenyl)-3-hydroxybutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-ethoxy-3-(ethoxymethyl)-1-(4-hexylphenyl)-3-hydroxybutan-2-yl]carbamate Traditional Name: N-[3-ethoxy-2-(ethoxymethyl)-1-(4-hexylbenzyl)-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C26H45NO5 MolecularWeight: 451.6392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)CC(C(COCC)(COCC)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)CC(C(COCC)(COCC)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H45NO5/c1-7-10-11-12-13-21-14-16-22(17-15-21)18-23(27-24(28)32-25(4,5)6)26(29,19-30-8-2)20-31-9-3/h14-17,23,29H,7-13,18-20H2,1-6H3,(H,27,28)