[3-methoxy-4-[(2R)-2-oxidanyl-3-(4-oxidanylpiperidin-1-ium-1-yl)propoxy]phenyl]methyl-(2-methylprop-2-enyl)azanium

Systemtic Name: [3-methoxy-4-[(2R)-2-oxidanyl-3-(4-oxidanylpiperidin-1-ium-1-yl)propoxy]phenyl]methyl-(2-methylprop-2-enyl)azanium Openeye Name: [4-[(2R)-2-hydroxy-3-(4-hydroxypiperidin-1-ium-1-yl)propoxy]-3-methoxy-phenyl]methyl-(2-methylallyl)ammonium CAS Name: [4-[(2R)-2-hydroxy-3-(4-hydroxy-1-piperidin-1-iumyl)propoxy]-3-methoxyphenyl]methyl-(2-methylprop-2-enyl)ammonium IUPAC Name: [4-[(2R)-2-hydroxy-3-(4-hydroxypiperidin-1-ium-1-yl)propoxy]-3-methoxyphenyl]methyl-(2-methylprop-2-enyl)azanium Traditional Name: [4-[(2R)-2-hydroxy-3-(4-hydroxypiperidin-1-ium-1-yl)propoxy]-3-methoxy-benzyl]-(2-methylallyl)ammonium Formula: C20H34N2O4+2 MolecularWeight: 366.49496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[NH2+]CC1=CC(=C(C=C1)OCC(C[NH+]2CCC(CC2)O)O)OC

Isomeric SMILES

CC(=C)C[NH2+]CC1=CC(=C(C=C1)OC[C@@H](C[NH+]2CCC(CC2)O)O)OC

InChI

InChI=1S/C20H32N2O4/c1-15(2)11-21-12-16-4-5-19(20(10-16)25-3)26-14-18(24)13-22-8-6-17(23)7-9-22/h4-5,10,17-18,21,23-24H,1,6-9,11-14H2,2-3H3/p+2/t18-/m1/s1