N-ethyl-2-[(2R)-1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-methylprop-2-enyl)ethanamide

Systemtic Name: N-ethyl-2-[(2R)-1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-methylprop-2-enyl)ethanamide Openeye Name: N-ethyl-2-[(2R)-1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(2-methylallyl)acetamide CAS Name: N-ethyl-2-[(2R)-1-[(4-methoxy-3-methylphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(2-methylprop-2-enyl)acetamide IUPAC Name: N-ethyl-2-[(2R)-1-[(4-methoxy-3-methylphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(2-methylprop-2-enyl)acetamide Traditional Name: N-ethyl-2-[(2R)-3-keto-1-(4-methoxy-3-methyl-benzyl)piperazin-1-ium-2-yl]-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(=C(C=C2)OC)C

Isomeric SMILES

CCN(CC(=C)C)C(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC(=C(C=C2)OC)C

InChI

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