1-[3-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[3-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one Openeye Name: 1-[3-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[3-[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[3-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[3-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-carbonyl]phenyl]-2-pyrrolidone Formula: C21H29N4O4+ MolecularWeight: 401.47936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C21H28N4O4/c26-19-5-2-6-25(19)18-4-1-3-17(15-18)21(28)24-9-7-22(8-10-24)16-20(27)23-11-13-29-14-12-23/h1,3-4,15H,2,5-14,16H2/p+1