2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-ethyl-N-(2-methylprop-2-enyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-ethyl-N-(2-methylprop-2-enyl)ethanamide Openeye Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-ethyl-N-(2-methylallyl)acetamide CAS Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide IUPAC Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide Traditional Name: 2-[(2R)-1-(2-ethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-ethyl-N-(2-methylallyl)acetamide Formula: C21H32N3O3+ MolecularWeight: 374.49708

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)CC1C(=O)NCC[NH+]1CC2=CC=CC=C2OCC

Isomeric SMILES

CCN(CC(=C)C)C(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC=CC=C2OCC

InChI

InChI=1S/C21H31N3O3/c1-5-23(14-16(3)4)20(25)13-18-21(26)22-11-12-24(18)15-17-9-7-8-10-19(17)27-6-2/h7-10,18H,3,5-6,11-15H2,1-2,4H3,(H,22,26)/p+1/t18-/m1/s1