1-[2-chloranyl-5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-phenyl]pyrrolidin-2-one

Systemtic Name: 1-[2-chloranyl-5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-phenyl]pyrrolidin-2-one Openeye Name: 1-[2-chloro-5-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[2-chloro-5-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[2-chloro-5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[2-chloro-5-[4-(coumaran-5-ylmethyl)piperazin-4-ium-1-carbonyl]phenyl]-2-pyrrolidone Formula: C24H27ClN3O3+ MolecularWeight: 440.94248

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCC5)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCC5)Cl

InChI

InChI=1S/C24H26ClN3O3/c25-20-5-4-19(15-21(20)28-8-1-2-23(28)29)24(30)27-11-9-26(10-12-27)16-17-3-6-22-18(14-17)7-13-31-22/h3-6,14-15H,1-2,7-13,16H2/p+1