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

Systemtic Name: tert-butyl N-[5-methyl-4-oxidanylidene-2-[2-phenylmethoxy-2-(pyridin-3-ylmethylcarbamoyl)pyrrolidin-1-yl]-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[2-[2-benzyloxy-2-(3-pyridylmethylcarbamoyl)pyrrolidin-1-yl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[5-methyl-4-oxo-2-[2-[oxo-(3-pyridinylmethylamino)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-(pyridin-3-ylmethylcarbamoyl)pyrrolidin-1-yl]-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[2-[2-benzoxy-2-(3-pyridylmethylcarbamoyl)pyrrolidino]-4-keto-5-methyl-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C32H35N5O6 MolecularWeight: 585.6502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCCC3(C(=O)NCC4=CN=CC=C4)OCC5=CC=CC=C5)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCCC3(C(=O)NCC4=CN=CC=C4)OCC5=CC=CC=C5)NC(=O)OC(C)(C)C

InChI

InChI=1S/C32H35N5O6/c1-21-24(36-30(40)43-31(2,3)4)13-14-25-26(21)27(38)42-29(35-25)37-17-9-15-32(37,41-20-22-10-6-5-7-11-22)28(39)34-19-23-12-8-16-33-18-23/h5-8,10-14,16,18H,9,15,17,19-20H2,1-4H3,(H,34,39)(H,36,40)