N-[(1-ethylimidazol-2-yl)methyl]-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-ethanamide

Systemtic Name: N-[(1-ethylimidazol-2-yl)methyl]-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-ethanamide Openeye Name: N-[(1-ethylimidazol-2-yl)methyl]-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-methyl-acetamide CAS Name: N-[(1-ethyl-2-imidazolyl)methyl]-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[(1-ethylimidazol-2-yl)methyl]-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methylacetamide Traditional Name: N-[(1-ethylimidazol-2-yl)methyl]-2-[(2R)-3-keto-1-o-anisyl-piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C21H30N5O3+ MolecularWeight: 400.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1CN(C)C(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC=C3OC

Isomeric SMILES

CCN1C=CN=C1CN(C)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC=CC=C3OC

InChI

InChI=1S/C21H29N5O3/c1-4-25-11-9-22-19(25)15-24(2)20(27)13-17-21(28)23-10-12-26(17)14-16-7-5-6-8-18(16)29-3/h5-9,11,17H,4,10,12-15H2,1-3H3,(H,23,28)/p+1/t17-/m1/s1