N-(4-methoxy-2-nitro-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(4-methoxy-2-nitrophenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Formula: C15H22N3O4+ MolecularWeight: 308.35288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O4/c1-11-5-3-4-8-17(11)10-15(19)16-13-7-6-12(22-2)9-14(13)18(20)21/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,16,19)/p+1/t11-/m0/s1