N-(2-methoxy-4-nitro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(2-methoxy-4-nitrophenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C15H22N3O4+ MolecularWeight: 308.35288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H21N3O4/c1-11-4-3-7-17(9-11)10-15(19)16-13-6-5-12(18(20)21)8-14(13)22-2/h5-6,8,11H,3-4,7,9-10H2,1-2H3,(H,16,19)/p+1/t11-/m0/s1