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

Systemtic Name: [3-methoxy-2-[(2R)-3-morpholin-4-yl-2-oxidanyl-propoxy]phenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [2-[(2R)-2-hydroxy-3-morpholino-propoxy]-3-methoxy-phenyl]methyl-methyl-(2-thienylmethyl)ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(4-morpholinyl)propoxy]-3-methoxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ylpropoxy]-3-methoxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [2-[(2R)-2-hydroxy-3-morpholino-propoxy]-3-methoxy-benzyl]-methyl-(2-thenyl)ammonium Formula: C21H31N2O4S+ MolecularWeight: 407.54684

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OCC(CN2CCOCC2)O)CC3=CC=CS3

Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC[C@@H](CN2CCOCC2)O)CC3=CC=CS3

InChI

InChI=1S/C21H30N2O4S/c1-22(15-19-6-4-12-28-19)13-17-5-3-7-20(25-2)21(17)27-16-18(24)14-23-8-10-26-11-9-23/h3-7,12,18,24H,8-11,13-16H2,1-2H3/p+1/t18-/m1/s1