tert-butyl N-[(E,2S)-4-cyclohexyl-1-phenyl-but-3-en-2-yl]-N-(4-methoxyphenyl)carbamate

Systemtic Name: tert-butyl N-[(E,2S)-4-cyclohexyl-1-phenyl-but-3-en-2-yl]-N-(4-methoxyphenyl)carbamate Openeye Name: tert-butyl N-[(E,1S)-1-benzyl-3-cyclohexyl-allyl]-N-(4-methoxyphenyl)carbamate CAS Name: N-[(E,2S)-4-cyclohexyl-1-phenylbut-3-en-2-yl]-N-(4-methoxyphenyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E,2S)-4-cyclohexyl-1-phenylbut-3-en-2-yl]-N-(4-methoxyphenyl)carbamate Traditional Name: N-[(E,1S)-1-benzyl-3-cyclohexyl-allyl]-N-(4-methoxyphenyl)carbamic acid tert-butyl ester Formula: C28H37NO3 MolecularWeight: 435.59828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=CC=C(C=C1)OC)C(CC2=CC=CC=C2)C=CC3CCCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC=C(C=C1)OC)[C@@H](CC2=CC=CC=C2)/C=C/C3CCCCC3

InChI

InChI=1S/C28H37NO3/c1-28(2,3)32-27(30)29(24-17-19-26(31-4)20-18-24)25(21-23-13-9-6-10-14-23)16-15-22-11-7-5-8-12-22/h6,9-10,13-20,22,25H,5,7-8,11-12,21H2,1-4H3/b16-15+/t25-/m1/s1