2-[4-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[(1S)-2-morpholino-2-oxo-1-phenyl-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[(1S)-2-keto-2-morpholino-1-phenyl-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C21H31N4O3+ MolecularWeight: 387.49584

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C[NH+]1CCN(CC1)C(C2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

C=CCNC(=O)C[NH+]1CCN(CC1)[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C21H30N4O3/c1-2-8-22-19(26)17-23-9-11-24(12-10-23)20(18-6-4-3-5-7-18)21(27)25-13-15-28-16-14-25/h2-7,20H,1,8-17H2,(H,22,26)/p+1/t20-/m0/s1