[4-methoxy-2-[1-[[(3R)-oxolan-3-yl]methyl]piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-methoxy-2-[1-[[(3R)-oxolan-3-yl]methyl]piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-methoxy-2-[1-[[(3R)-tetrahydrofuran-3-yl]methyl]piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-methoxy-2-[[1-[[(3R)-3-oxolanyl]methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-methoxy-2-[1-[[(3R)-oxolan-3-yl]methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-methoxy-2-[1-[[(3R)-tetrahydrofuran-3-yl]methyl]piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidino-methanone Formula: C22H33N2O4+ MolecularWeight: 389.50842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)CC4CCOC4

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)C[C@H]4CCOC4

InChI

InChI=1S/C22H32N2O4/c1-26-19-4-5-20(22(25)24-9-2-3-10-24)21(14-19)28-18-6-11-23(12-7-18)15-17-8-13-27-16-17/h4-5,14,17-18H,2-3,6-13,15-16H2,1H3/p+1/t17-/m1/s1