methyl 5-[[2-(4-bromophenyl)propan-2-ylamino]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2-(4-bromophenyl)propan-2-ylamino]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[[1-(4-bromophenyl)-1-methyl-ethyl]amino]methyl]furan-2-carboxylate CAS Name: 5-[[2-(4-bromophenyl)propan-2-ylamino]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(4-bromophenyl)propan-2-ylamino]methyl]furan-2-carboxylate Traditional Name: 5-[[[1-(4-bromophenyl)-1-methyl-ethyl]amino]methyl]furan-2-carboxylic acid methyl ester Formula: C16H18BrNO3 MolecularWeight: 352.22302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)Br)NCC2=CC=C(O2)C(=O)OC

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)Br)NCC2=CC=C(O2)C(=O)OC

InChI

InChI=1S/C16H18BrNO3/c1-16(2,11-4-6-12(17)7-5-11)18-10-13-8-9-14(21-13)15(19)20-3/h4-9,18H,10H2,1-3H3