[4-methoxy-3-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl-methyl-[(3-methylpyridin-4-yl)methyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C[NH+](C)CC2=CC(=C(C=C2)OC)OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

CC1=C(C=CN=C1)C[NH+](C)CC2=CC(=C(C=C2)OC)OC[C@H](C[NH+]3CCCCC3)O

InChI

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