3-bromanyl-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxy-5-nitro-benzamide

Systemtic Name: 3-bromanyl-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxy-5-nitro-benzamide Openeye Name: 3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxy-5-nitro-benzamide CAS Name: 3-bromo-N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2,6-dimethoxy-5-nitrobenzamide IUPAC Name: 3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxy-5-nitrobenzamide Traditional Name: 3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxy-5-nitro-benzamide Formula: C16H22BrN3O5 MolecularWeight: 416.26698

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2OC)Br)[N+](=O)[O-])OC

Isomeric SMILES

CCN1CCC[C@H]1CNC(=O)C2=C(C(=CC(=C2OC)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C16H22BrN3O5/c1-4-19-7-5-6-10(19)9-18-16(21)13-14(24-2)11(17)8-12(20(22)23)15(13)25-3/h8,10H,4-7,9H2,1-3H3,(H,18,21)/t10-/m0/s1