tert-butyl N-[[4-[[3-(2-methylpropanoylamino)phenyl]methoxy]phenyl]methyl]-N-phenethyl-carbamate

Systemtic Name: tert-butyl N-[[4-[[3-(2-methylpropanoylamino)phenyl]methoxy]phenyl]methyl]-N-phenethyl-carbamate Openeye Name: tert-butyl N-[[4-[[3-(2-methylpropanoylamino)phenyl]methoxy]phenyl]methyl]-N-phenethyl-carbamate CAS Name: N-[[4-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methoxy]phenyl]methyl]-N-phenethylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[[3-(2-methylpropanoylamino)phenyl]methoxy]phenyl]methyl]-N-phenethylcarbamate Traditional Name: N-[4-[3-(isobutyrylamino)benzyl]oxybenzyl]-N-phenethyl-carbamic acid tert-butyl ester Formula: C31H38N2O4 MolecularWeight: 502.64442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)COC2=CC=C(C=C2)CN(CCC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)COC2=CC=C(C=C2)CN(CCC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H38N2O4/c1-23(2)29(34)32-27-13-9-12-26(20-27)22-36-28-16-14-25(15-17-28)21-33(30(35)37-31(3,4)5)19-18-24-10-7-6-8-11-24/h6-17,20,23H,18-19,21-22H2,1-5H3,(H,32,34)