tert-butyl 2-(cyclohexylmethyl)-6-(methylamino)-5-[(4-methylphenyl)methyl]-3-oxidanyl-6-oxidanylidene-hexanoate

Systemtic Name: tert-butyl 2-(cyclohexylmethyl)-6-(methylamino)-5-[(4-methylphenyl)methyl]-3-oxidanyl-6-oxidanylidene-hexanoate Openeye Name: tert-butyl 2-(cyclohexylmethyl)-3-hydroxy-6-(methylamino)-6-oxo-5-(p-tolylmethyl)hexanoate CAS Name: 2-(cyclohexylmethyl)-3-hydroxy-6-(methylamino)-5-[(4-methylphenyl)methyl]-6-oxohexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(cyclohexylmethyl)-3-hydroxy-6-(methylamino)-5-[(4-methylphenyl)methyl]-6-oxohexanoate Traditional Name: 2-(cyclohexylmethyl)-3-hydroxy-6-keto-6-(methylamino)-5-(4-methylbenzyl)hexanoic acid tert-butyl ester Formula: C26H41NO4 MolecularWeight: 431.60804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(CC(C(CC2CCCCC2)C(=O)OC(C)(C)C)O)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)CC(CC(C(CC2CCCCC2)C(=O)OC(C)(C)C)O)C(=O)NC

InChI

InChI=1S/C26H41NO4/c1-18-11-13-20(14-12-18)15-21(24(29)27-5)17-23(28)22(25(30)31-26(2,3)4)16-19-9-7-6-8-10-19/h11-14,19,21-23,28H,6-10,15-17H2,1-5H3,(H,27,29)