tert-butyl N-[2,2-dimethyl-5-[2-(4-octanoylphenyl)ethyl]-1,3-dioxan-5-yl]carbamate

Systemtic Name: tert-butyl N-[2,2-dimethyl-5-[2-(4-octanoylphenyl)ethyl]-1,3-dioxan-5-yl]carbamate Openeye Name: tert-butyl N-[2,2-dimethyl-5-[2-(4-octanoylphenyl)ethyl]-1,3-dioxan-5-yl]carbamate CAS Name: N-[2,2-dimethyl-5-[2-[4-(1-oxooctyl)phenyl]ethyl]-1,3-dioxan-5-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2,2-dimethyl-5-[2-(4-octanoylphenyl)ethyl]-1,3-dioxan-5-yl]carbamate Traditional Name: N-[5-[2-(4-caprylylphenyl)ethyl]-2,2-dimethyl-1,3-dioxan-5-yl]carbamic acid tert-butyl ester Formula: C27H43NO5 MolecularWeight: 461.63402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC=C(C=C1)CCC2(COC(OC2)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCC(=O)C1=CC=C(C=C1)CCC2(COC(OC2)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H43NO5/c1-7-8-9-10-11-12-23(29)22-15-13-21(14-16-22)17-18-27(19-31-26(5,6)32-20-27)28-24(30)33-25(2,3)4/h13-16H,7-12,17-20H2,1-6H3,(H,28,30)