tert-butyl N-[(2R)-1-[1-(1,3-benzodioxol-5-yl)propan-2-yl-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[1-(1,3-benzodioxol-5-yl)propan-2-yl-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-[[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]-methyl-amino]-1-benzyl-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-1-[1-(1,3-benzodioxol-5-yl)propan-2-yl-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-[1-(1,3-benzodioxol-5-yl)propan-2-yl-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1R)-2-[[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]-methyl-amino]-1-benzyl-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H32N2O5 MolecularWeight: 440.53198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)OCO2)N(C)C(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(CC1=CC2=C(C=C1)OCO2)N(C)C(=O)[C@@H](CC3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H32N2O5/c1-17(13-19-11-12-21-22(15-19)31-16-30-21)27(5)23(28)20(14-18-9-7-6-8-10-18)26-24(29)32-25(2,3)4/h6-12,15,17,20H,13-14,16H2,1-5H3,(H,26,29)/t17?,20-/m1/s1