(4S)-4-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]amino]-1-phenethyl-pyrrolidin-2-one

Systemtic Name: (4S)-4-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]amino]-1-phenethyl-pyrrolidin-2-one Openeye Name: (4S)-4-[[1-(2-furylmethyl)piperidin-1-ium-4-yl]amino]-1-phenethyl-pyrrolidin-2-one CAS Name: (4S)-4-[[1-(2-furanylmethyl)-4-piperidin-1-iumyl]amino]-1-phenethyl-2-pyrrolidinone IUPAC Name: (4S)-4-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]amino]-1-phenethylpyrrolidin-2-one Traditional Name: (4S)-4-[[1-(2-furfuryl)piperidin-1-ium-4-yl]amino]-1-phenethyl-2-pyrrolidone Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2CC(=O)N(C2)CCC3=CC=CC=C3)CC4=CC=CO4

Isomeric SMILES

C1C[NH+](CCC1N[C@H]2CC(=O)N(C2)CCC3=CC=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C22H29N3O2/c26-22-15-20(16-25(22)13-8-18-5-2-1-3-6-18)23-19-9-11-24(12-10-19)17-21-7-4-14-27-21/h1-7,14,19-20,23H,8-13,15-17H2/p+1/t20-/m0/s1