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

Systemtic Name: [3-methoxy-2-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl-[(3-methylphenyl)methyl]azanium Openeye Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]-3-methoxy-phenyl]methyl-(m-tolylmethyl)ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]-3-methoxyphenyl]methyl-[(3-methylphenyl)methyl]ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]-3-methoxyphenyl]methyl-[(3-methylphenyl)methyl]azanium Traditional Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]-3-methoxy-benzyl]-(3-methylbenzyl)ammonium Formula: C23H34N2O4+2 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH2+]CC2=C(C(=CC=C2)OC)OCC(C[NH+]3CCOCC3)O

Isomeric SMILES

CC1=CC(=CC=C1)C[NH2+]CC2=C(C(=CC=C2)OC)OC[C@@H](C[NH+]3CCOCC3)O

InChI

InChI=1S/C23H32N2O4/c1-18-5-3-6-19(13-18)14-24-15-20-7-4-8-22(27-2)23(20)29-17-21(26)16-25-9-11-28-12-10-25/h3-8,13,21,24,26H,9-12,14-17H2,1-2H3/p+2/t21-/m1/s1