tert-butyl N-[(E,3S,4S)-3-cyclohexyl-4-oxidanyl-4-phenyl-but-1-enyl]-N-(4-methoxyphenyl)carbamate

Systemtic Name: tert-butyl N-[(E,3S,4S)-3-cyclohexyl-4-oxidanyl-4-phenyl-but-1-enyl]-N-(4-methoxyphenyl)carbamate Openeye Name: tert-butyl N-[(E,3S,4S)-3-cyclohexyl-4-hydroxy-4-phenyl-but-1-enyl]-N-(4-methoxyphenyl)carbamate CAS Name: N-[(E,3S,4S)-3-cyclohexyl-4-hydroxy-4-phenylbut-1-enyl]-N-(4-methoxyphenyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E,3S,4S)-3-cyclohexyl-4-hydroxy-4-phenylbut-1-enyl]-N-(4-methoxyphenyl)carbamate Traditional Name: N-[(E,3S,4S)-3-cyclohexyl-4-hydroxy-4-phenyl-but-1-enyl]-N-(4-methoxyphenyl)carbamic acid tert-butyl ester Formula: C28H37NO4 MolecularWeight: 451.59768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C=CC(C1CCCCC1)C(C2=CC=CC=C2)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N(/C=C/[C@H](C1CCCCC1)[C@@H](C2=CC=CC=C2)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H37NO4/c1-28(2,3)33-27(31)29(23-15-17-24(32-4)18-16-23)20-19-25(21-11-7-5-8-12-21)26(30)22-13-9-6-10-14-22/h6,9-10,13-21,25-26,30H,5,7-8,11-12H2,1-4H3/b20-19+/t25-,26-/m1/s1