[4-methoxy-3-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl-(3-morpholin-4-ylpropyl)azanium

Systemtic Name: [4-methoxy-3-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl-(3-morpholin-4-ylpropyl)azanium Openeye Name: [3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-phenyl]methyl-(3-morpholinopropyl)ammonium CAS Name: [3-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-4-methoxyphenyl]methyl-[3-(4-morpholinyl)propyl]ammonium IUPAC Name: [3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-4-methoxyphenyl]methyl-(3-morpholin-4-ylpropyl)azanium Traditional Name: [3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-benzyl]-(3-morpholinopropyl)ammonium Formula: C22H39N3O4+2 MolecularWeight: 409.56276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CCCN2CCOCC2)OCC(C[NH+]3CCCC3)O

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CCCN2CCOCC2)OC[C@@H](C[NH+]3CCCC3)O

InChI

InChI=1S/C22H37N3O4/c1-27-21-6-5-19(16-23-7-4-10-24-11-13-28-14-12-24)15-22(21)29-18-20(26)17-25-8-2-3-9-25/h5-6,15,20,23,26H,2-4,7-14,16-18H2,1H3/p+2/t20-/m1/s1