3-[(3R)-1-[[3-(5-methylfuran-2-yl)phenyl]methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[(3R)-1-[[3-(5-methylfuran-2-yl)phenyl]methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[(3R)-1-[[3-(5-methyl-2-furyl)phenyl]methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(3R)-1-[[3-(5-methyl-2-furanyl)phenyl]methyl]-3-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[(3R)-1-[[3-(5-methylfuran-2-yl)phenyl]methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(3R)-1-[3-(5-methyl-2-furyl)benzyl]piperidin-1-ium-3-yl]-1-pyrrolidino-propan-1-one Formula: C24H33N2O2+ MolecularWeight: 381.53102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=CC(=CC=C2)C[NH+]3CCCC(C3)CCC(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(O1)C2=CC(=CC=C2)C[NH+]3CCC[C@@H](C3)CCC(=O)N4CCCC4

InChI

InChI=1S/C24H32N2O2/c1-19-9-11-23(28-19)22-8-4-6-21(16-22)18-25-13-5-7-20(17-25)10-12-24(27)26-14-2-3-15-26/h4,6,8-9,11,16,20H,2-3,5,7,10,12-15,17-18H2,1H3/p+1/t20-/m1/s1