(5-ethylpyridin-2-yl)methyl-[[4-methoxy-2-[(2S)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl]-methyl-azanium

Systemtic Name: (5-ethylpyridin-2-yl)methyl-[[4-methoxy-2-[(2S)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl]-methyl-azanium Openeye Name: (5-ethyl-2-pyridyl)methyl-[[2-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-phenyl]methyl]-methyl-ammonium CAS Name: (5-ethyl-2-pyridinyl)methyl-[[2-[(2S)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-4-methoxyphenyl]methyl]-methylammonium IUPAC Name: (5-ethylpyridin-2-yl)methyl-[[2-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-4-methoxyphenyl]methyl]-methylazanium Traditional Name: (5-ethyl-2-pyridyl)methyl-[2-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-benzyl]-methyl-ammonium Formula: C24H37N3O3+2 MolecularWeight: 415.56888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C[NH+](C)CC2=C(C=C(C=C2)OC)OCC(C[NH+]3CCCC3)O

Isomeric SMILES

CCC1=CN=C(C=C1)C[NH+](C)CC2=C(C=C(C=C2)OC)OC[C@H](C[NH+]3CCCC3)O

InChI

InChI=1S/C24H35N3O3/c1-4-19-7-9-21(25-14-19)16-26(2)15-20-8-10-23(29-3)13-24(20)30-18-22(28)17-27-11-5-6-12-27/h7-10,13-14,22,28H,4-6,11-12,15-18H2,1-3H3/p+2/t22-/m0/s1