2-methoxy-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-5-nitro-benzamide

Systemtic Name: 2-methoxy-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-5-nitro-benzamide Openeye Name: 2-methoxy-N-[3-[(2S)-2-methyl-1-piperidyl]propyl]-5-nitro-benzamide CAS Name: 2-methoxy-N-[3-[(2S)-2-methyl-1-piperidinyl]propyl]-5-nitrobenzamide IUPAC Name: 2-methoxy-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-5-nitrobenzamide Traditional Name: 2-methoxy-N-[3-[(2S)-2-methylpiperidino]propyl]-5-nitro-benzamide Formula: C17H25N3O4 MolecularWeight: 335.3981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

C[C@H]1CCCCN1CCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H25N3O4/c1-13-6-3-4-10-19(13)11-5-9-18-17(21)15-12-14(20(22)23)7-8-16(15)24-2/h7-8,12-13H,3-6,9-11H2,1-2H3,(H,18,21)/t13-/m0/s1