N-(2-morpholin-4-ylethyl)-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-(2-morpholinoethyl)-2-[(2R)-3-oxo-1-phenethyl-piperazin-1-ium-2-yl]acetamide CAS Name: N-[2-(4-morpholinyl)ethyl]-2-[(2R)-3-oxo-1-phenethyl-2-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-morpholin-4-ylethyl)-2-[(2R)-3-oxo-1-phenethylpiperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-phenethyl-piperazin-1-ium-2-yl]-N-(2-morpholinoethyl)acetamide Formula: C20H31N4O3+ MolecularWeight: 375.48514

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCN2CCOCC2)CCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCN2CCOCC2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H30N4O3/c25-19(21-7-10-23-12-14-27-15-13-23)16-18-20(26)22-8-11-24(18)9-6-17-4-2-1-3-5-17/h1-5,18H,6-16H2,(H,21,25)(H,22,26)/p+1/t18-/m1/s1