(4-nitrophenyl) N-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]carbamate

Systemtic Name: (4-nitrophenyl) N-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]carbamate Openeye Name: (4-nitrophenyl) N-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]carbamate CAS Name: N-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]-2-pyrimidinyl]carbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]carbamate Traditional Name: N-[4-[3-(3-bromophenyl)anthranil-5-yl]pyrimidin-2-yl]carbamic acid (4-nitrophenyl) ester Formula: C24H14BrN5O5 MolecularWeight: 532.30246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC(=O)OC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC(=O)OC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H14BrN5O5/c25-16-3-1-2-15(12-16)22-19-13-14(4-9-21(19)29-35-22)20-10-11-26-23(27-20)28-24(31)34-18-7-5-17(6-8-18)30(32)33/h1-13H,(H,26,27,28,31)