2-[4-(4-ethoxyphenyl)carbonylpiperidin-1-ium-1-yl]-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-(4-ethoxyphenyl)carbonylpiperidin-1-ium-1-yl]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[4-(4-ethoxybenzoyl)piperidin-1-ium-1-yl]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[4-[(4-ethoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[4-(4-ethoxybenzoyl)piperidin-1-ium-1-yl]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[4-(4-ethoxybenzoyl)piperidin-1-ium-1-yl]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C23H28N3O5+ MolecularWeight: 426.48552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H27N3O5/c1-3-31-20-8-5-17(6-9-20)23(28)18-10-12-25(13-11-18)15-22(27)24-21-14-19(26(29)30)7-4-16(21)2/h4-9,14,18H,3,10-13,15H2,1-2H3,(H,24,27)/p+1