(phenylmethyl) N-[5-bromanyl-2-(phenylmethoxycarbonylamino)pyridin-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[5-bromanyl-2-(phenylmethoxycarbonylamino)pyridin-3-yl]carbamate Openeye Name: benzyl N-[2-(benzyloxycarbonylamino)-5-bromo-3-pyridyl]carbamate CAS Name: N-[5-bromo-2-(phenylmethoxycarbonylamino)-3-pyridinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-bromo-2-(phenylmethoxycarbonylamino)pyridin-3-yl]carbamate Traditional Name: N-[2-(benzyloxycarbonylamino)-5-bromo-3-pyridyl]carbamic acid benzyl ester Formula: C21H18BrN3O4 MolecularWeight: 456.28932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CC(=CN=C2NC(=O)OCC3=CC=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CC(=CN=C2NC(=O)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C21H18BrN3O4/c22-17-11-18(24-20(26)28-13-15-7-3-1-4-8-15)19(23-12-17)25-21(27)29-14-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,24,26)(H,23,25,27)