tert-butyl 4-methyl-2-[[3-(2-methylphenoxy)phenyl]methyl]-5-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-methyl-2-[[3-(2-methylphenoxy)phenyl]methyl]-5-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 4-methyl-2-[[3-(2-methylphenoxy)phenyl]methyl]-5-oxo-piperazine-1-carboxylate CAS Name: 4-methyl-2-[[3-(2-methylphenoxy)phenyl]methyl]-5-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-methyl-2-[[3-(2-methylphenoxy)phenyl]methyl]-5-oxopiperazine-1-carboxylate Traditional Name: 5-keto-4-methyl-2-[3-(2-methylphenoxy)benzyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H30N2O4 MolecularWeight: 410.506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=CC(=C2)CC3CN(C(=O)CN3C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=CC(=C2)CC3CN(C(=O)CN3C(=O)OC(C)(C)C)C

InChI

InChI=1S/C24H30N2O4/c1-17-9-6-7-12-21(17)29-20-11-8-10-18(14-20)13-19-15-25(5)22(27)16-26(19)23(28)30-24(2,3)4/h6-12,14,19H,13,15-16H2,1-5H3