N-(3,4-diethoxyphenyl)-2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[4-(2-keto-2-morpholino-ethyl)piperazin-1-ium-1-yl]acetamide Formula: C22H35N4O5+ MolecularWeight: 435.5371

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)CC(=O)N3CCOCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)CC(=O)N3CCOCC3)OCC

InChI

InChI=1S/C22H34N4O5/c1-3-30-19-6-5-18(15-20(19)31-4-2)23-21(27)16-24-7-9-25(10-8-24)17-22(28)26-11-13-29-14-12-26/h5-6,15H,3-4,7-14,16-17H2,1-2H3,(H,23,27)/p+1