dimethyl (E)-3-[2-bromanylprop-2-enyl-(phenylmethyl)amino]pent-2-enedioate

Systemtic Name: dimethyl (E)-3-[2-bromanylprop-2-enyl-(phenylmethyl)amino]pent-2-enedioate Openeye Name: dimethyl (E)-3-[benzyl(2-bromoallyl)amino]pent-2-enedioate CAS Name: (E)-3-[2-bromoprop-2-enyl-(phenylmethyl)amino]-2-pentenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-3-[benzyl(2-bromoprop-2-enyl)amino]pent-2-enedioate Traditional Name: (E)-3-[benzyl(2-bromoallyl)amino]pent-2-enedioic acid dimethyl ester Formula: C17H20BrNO4 MolecularWeight: 382.249

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=CC(=O)OC)N(CC1=CC=CC=C1)CC(=C)Br

Isomeric SMILES

COC(=O)C/C(=C\C(=O)OC)/N(CC1=CC=CC=C1)CC(=C)Br

InChI

InChI=1S/C17H20BrNO4/c1-13(18)11-19(12-14-7-5-4-6-8-14)15(9-16(20)22-2)10-17(21)23-3/h4-9H,1,10-12H2,2-3H3/b15-9+