(2,2-dimethyl-3-oxidanyl-propyl)-[[3-methoxy-4-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: (2,2-dimethyl-3-oxidanyl-propyl)-[[3-methoxy-4-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: (3-hydroxy-2,2-dimethyl-propyl)-[[4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: (3-hydroxy-2,2-dimethylpropyl)-[[4-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-3-methoxyphenyl]methyl]ammonium IUPAC Name: (3-hydroxy-2,2-dimethylpropyl)-[[4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: (3-hydroxy-2,2-dimethyl-propyl)-[4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-3-methoxy-benzyl]ammonium Formula: C20H36N2O4+2 MolecularWeight: 368.51084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CC(=C(C=C1)OCC(C[NH+]2CCCC2)O)OC)CO

Isomeric SMILES

CC(C)(C[NH2+]CC1=CC(=C(C=C1)OC[C@@H](C[NH+]2CCCC2)O)OC)CO

InChI

InChI=1S/C20H34N2O4/c1-20(2,15-23)14-21-11-16-6-7-18(19(10-16)25-3)26-13-17(24)12-22-8-4-5-9-22/h6-7,10,17,21,23-24H,4-5,8-9,11-15H2,1-3H3/p+2/t17-/m1/s1