N-(2-methyl-6-nitro-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(2-methyl-6-nitro-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-(4-phenethyl-1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-(2-methyl-6-nitro-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)acetamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+]2CCC(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+]2CCC(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c1-17-6-5-9-20(25(27)28)22(17)23-21(26)16-24-14-12-19(13-15-24)11-10-18-7-3-2-4-8-18/h2-9,19H,10-16H2,1H3,(H,23,26)/p+1