5-bromanyl-N-[[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]methyl]-2,3-dimethoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]methyl]-2,3-dimethoxy-benzamide Openeye Name: 5-bromo-N-[[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]methyl]-2,3-dimethoxy-benzamide CAS Name: 5-bromo-N-[[(2S)-1-[(4-fluorophenyl)methyl]-2-pyrrolidinyl]methyl]-2,3-dimethoxybenzamide IUPAC Name: 5-bromo-N-[[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]methyl]-2,3-dimethoxybenzamide Traditional Name: 5-bromo-N-[[(2S)-1-(4-fluorobenzyl)pyrrolidin-2-yl]methyl]-2,3-dimethoxy-benzamide Formula: C21H24BrFN2O3 MolecularWeight: 451.329263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C(=O)NCC2CCCN2CC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C(=O)NC[C@@H]2CCCN2CC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H24BrFN2O3/c1-27-19-11-15(22)10-18(20(19)28-2)21(26)24-12-17-4-3-9-25(17)13-14-5-7-16(23)8-6-14/h5-8,10-11,17H,3-4,9,12-13H2,1-2H3,(H,24,26)/t17-/m0/s1