(4R)-1-(4-methylphenyl)-4-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: (4R)-1-(4-methylphenyl)-4-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: (4R)-4-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-carbonyl]-1-(p-tolyl)pyrrolidin-2-one CAS Name: (4R)-1-(4-methylphenyl)-4-[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-oxomethyl]-2-pyrrolidinone IUPAC Name: (4R)-1-(4-methylphenyl)-4-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-carbonyl]pyrrolidin-2-one Traditional Name: (4R)-4-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-carbonyl]-1-(p-tolyl)-2-pyrrolidone Formula: C22H31N4O4+ MolecularWeight: 415.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C22H30N4O4/c1-17-2-4-19(5-3-17)26-15-18(14-20(26)27)22(29)25-8-6-23(7-9-25)16-21(28)24-10-12-30-13-11-24/h2-5,18H,6-16H2,1H3/p+1/t18-/m1/s1