[1-[1-[[5-(methoxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]piperidin-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[[5-(methoxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]piperidin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[[5-(methoxymethyl)-2-furyl]methyl]piperidin-1-ium-4-yl]-4-piperidyl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[[5-(methoxymethyl)-2-furanyl]methyl]-4-piperidin-1-iumyl]-4-piperidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[[5-(methoxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]piperidin-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-[[5-(methoxymethyl)-2-furyl]methyl]piperidin-1-ium-4-yl]-4-piperidyl]-pyrrolidino-methanone Formula: C22H36N3O3+ MolecularWeight: 390.53954

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(O1)C[NH+]2CCC(CC2)N3CCC(CC3)C(=O)N4CCCC4

Isomeric SMILES

COCC1=CC=C(O1)C[NH+]2CCC(CC2)N3CCC(CC3)C(=O)N4CCCC4

InChI

InChI=1S/C22H35N3O3/c1-27-17-21-5-4-20(28-21)16-23-12-8-19(9-13-23)24-14-6-18(7-15-24)22(26)25-10-2-3-11-25/h4-5,18-19H,2-3,6-17H2,1H3/p+1