tert-butyl N-[1-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1-oxidanylidene-3-phenylmethoxy-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1-oxidanylidene-3-phenylmethoxy-butan-2-yl]carbamate Openeye Name: tert-butyl N-[2-benzyloxy-1-[(3-bromo-4,5-dihydroisoxazol-5-yl)methylcarbamoyl]propyl]carbamate CAS Name: N-[1-[(3-bromo-4,5-dihydroisoxazol-5-yl)methylamino]-1-oxo-3-phenylmethoxybutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylamino]-1-oxo-3-phenylmethoxybutan-2-yl]carbamate Traditional Name: N-[2-benzoxy-1-[(3-bromo-2-isoxazolin-5-yl)methylcarbamoyl]propyl]carbamic acid tert-butyl ester Formula: C20H28BrN3O5 MolecularWeight: 470.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NCC1CC(=NO1)Br)NC(=O)OC(C)(C)C)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(C(=O)NCC1CC(=NO1)Br)NC(=O)OC(C)(C)C)OCC2=CC=CC=C2

InChI

InChI=1S/C20H28BrN3O5/c1-13(27-12-14-8-6-5-7-9-14)17(23-19(26)28-20(2,3)4)18(25)22-11-15-10-16(21)24-29-15/h5-9,13,15,17H,10-12H2,1-4H3,(H,22,25)(H,23,26)