1-[2-chloranyl-5-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonyl-phenyl]pyrrolidin-2-one

Systemtic Name: 1-[2-chloranyl-5-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonyl-phenyl]pyrrolidin-2-one Openeye Name: 1-[2-chloro-5-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[2-chloro-5-[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[2-chloro-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[2-chloro-5-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-carbonyl]phenyl]-2-pyrrolidone Formula: C21H28ClN4O4+ MolecularWeight: 435.92442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN4O4/c22-17-4-3-16(14-18(17)26-5-1-2-19(26)27)21(29)25-8-6-23(7-9-25)15-20(28)24-10-12-30-13-11-24/h3-4,14H,1-2,5-13,15H2/p+1