tert-butyl N-[5-methyl-4-oxidanylidene-2-[2-phenylmethoxy-2-(2-pyridin-2-ylethylcarbamoyl)pyrrolidin-1-yl]-3,1-benzoxazin-6-yl]carbamate

Systemtic Name: tert-butyl N-[5-methyl-4-oxidanylidene-2-[2-phenylmethoxy-2-(2-pyridin-2-ylethylcarbamoyl)pyrrolidin-1-yl]-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[2-[2-benzyloxy-2-[2-(2-pyridyl)ethylcarbamoyl]pyrrolidin-1-yl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[5-methyl-4-oxo-2-[2-[oxo-[2-(2-pyridinyl)ethylamino]methyl]-2-phenylmethoxy-1-pyrrolidinyl]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-methyl-4-oxo-2-[2-phenylmethoxy-2-(2-pyridin-2-ylethylcarbamoyl)pyrrolidin-1-yl]-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[2-[2-benzoxy-2-[2-(2-pyridyl)ethylcarbamoyl]pyrrolidino]-4-keto-5-methyl-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C33H37N5O6 MolecularWeight: 599.67678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCCC3(C(=O)NCCC4=CC=CC=N4)OCC5=CC=CC=C5)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCCC3(C(=O)NCCC4=CC=CC=N4)OCC5=CC=CC=C5)NC(=O)OC(C)(C)C

InChI

InChI=1S/C33H37N5O6/c1-22-25(37-31(41)44-32(2,3)4)14-15-26-27(22)28(39)43-30(36-26)38-20-10-17-33(38,42-21-23-11-6-5-7-12-23)29(40)35-19-16-24-13-8-9-18-34-24/h5-9,11-15,18H,10,16-17,19-21H2,1-4H3,(H,35,40)(H,37,41)