methyl N-[3-(2-bromanyl-3,4,5-trimethoxy-phenyl)propanoylamino]carbamate

Systemtic Name: methyl N-[3-(2-bromanyl-3,4,5-trimethoxy-phenyl)propanoylamino]carbamate Openeye Name: methyl N-[3-(2-bromo-3,4,5-trimethoxy-phenyl)propanoylamino]carbamate CAS Name: N-[[3-(2-bromo-3,4,5-trimethoxyphenyl)-1-oxopropyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[3-(2-bromo-3,4,5-trimethoxyphenyl)propanoylamino]carbamate Traditional Name: N-[3-(2-bromo-3,4,5-trimethoxy-phenyl)propanoylamino]carbamic acid methyl ester Formula: C14H19BrN2O6 MolecularWeight: 391.21446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)CCC(=O)NNC(=O)OC)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)CCC(=O)NNC(=O)OC)Br)OC)OC

InChI

InChI=1S/C14H19BrN2O6/c1-20-9-7-8(11(15)13(22-3)12(9)21-2)5-6-10(18)16-17-14(19)23-4/h7H,5-6H2,1-4H3,(H,16,18)(H,17,19)