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

Systemtic Name: propan-2-yl 3-[(5-bromanylpyridin-3-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[(5-bromopyridine-3-carbonyl)amino]-3-phenyl-propanoate CAS Name: 3-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(5-bromopyridine-3-carbonyl)amino]-3-phenylpropanoate Traditional Name: 3-[(5-bromonicotinoyl)amino]-3-phenyl-propionic acid isopropyl ester Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C18H19BrN2O3/c1-12(2)24-17(22)9-16(13-6-4-3-5-7-13)21-18(23)14-8-15(19)11-20-10-14/h3-8,10-12,16H,9H2,1-2H3,(H,21,23)