(E)-5-[(2-bromanylpyridin-3-yl)methyl-phenylmethoxycarbonyl-amino]pent-2-enoate

Systemtic Name: (E)-5-[(2-bromanylpyridin-3-yl)methyl-phenylmethoxycarbonyl-amino]pent-2-enoate Openeye Name: (E)-5-[benzyloxycarbonyl-[(2-bromo-3-pyridyl)methyl]amino]pent-2-enoate CAS Name: (E)-5-[(2-bromo-3-pyridinyl)methyl-phenylmethoxycarbonylamino]-2-pentenoate IUPAC Name: (E)-5-[(2-bromopyridin-3-yl)methyl-phenylmethoxycarbonylamino]pent-2-enoate Traditional Name: (E)-5-[(2-bromo-3-pyridyl)methyl-carbobenzoxy-amino]pent-2-enoate Formula: C19H18BrN2O4- MolecularWeight: 418.26122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CCC=CC(=O)[O-])CC2=C(N=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CC/C=C/C(=O)[O-])CC2=C(N=CC=C2)Br

InChI

InChI=1S/C19H19BrN2O4/c20-18-16(9-6-11-21-18)13-22(12-5-4-10-17(23)24)19(25)26-14-15-7-2-1-3-8-15/h1-4,6-11H,5,12-14H2,(H,23,24)/p-1/b10-4+