3-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[1-[(3R)-3-(5-methyl-2-furyl)butyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[1-[(3R)-3-(5-methyl-2-furanyl)butyl]-4-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[1-[(3R)-3-(5-methyl-2-furyl)butyl]piperidin-1-ium-4-yl]-1-pyrrolidino-propan-1-one Formula: C21H35N2O2+ MolecularWeight: 347.5148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)CC[NH+]2CCC(CC2)CCC(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(O1)[C@H](C)CC[NH+]2CCC(CC2)CCC(=O)N3CCCC3

InChI

InChI=1S/C21H34N2O2/c1-17(20-7-5-18(2)25-20)9-14-22-15-10-19(11-16-22)6-8-21(24)23-12-3-4-13-23/h5,7,17,19H,3-4,6,8-16H2,1-2H3/p+1/t17-/m1/s1