propan-2-yl 3-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[(5-bromopyridine-3-carbonyl)amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(5-bromopyridine-3-carbonyl)amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[(5-bromonicotinoyl)amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C18H18BrN3O5 MolecularWeight: 436.25662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C18H18BrN3O5/c1-11(2)27-17(23)8-15(14-5-3-4-6-16(14)22(25)26)21-18(24)12-7-13(19)10-20-9-12/h3-7,9-11,15H,8H2,1-2H3,(H,21,24)