N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-6-methoxy-3-nitro-2-oxidanyl-benzamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-6-methoxy-3-nitro-2-oxidanyl-benzamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-3-nitro-benzamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2-hydroxy-6-methoxy-3-nitrobenzamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-3-nitrobenzamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-3-nitro-benzamide Formula: C15H21N3O5 MolecularWeight: 323.34434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=C(C=CC(=C2O)[N+](=O)[O-])OC

Isomeric SMILES

CCN1CCC[C@H]1CNC(=O)C2=C(C=CC(=C2O)[N+](=O)[O-])OC

InChI

InChI=1S/C15H21N3O5/c1-3-17-8-4-5-10(17)9-16-15(20)13-12(23-2)7-6-11(14(13)19)18(21)22/h6-7,10,19H,3-5,8-9H2,1-2H3,(H,16,20)/t10-/m0/s1