(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[(3-morpholinosulfonylphenyl)methyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-ethyl-[[3-(4-morpholinylsulfonyl)phenyl]methyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-ethyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-ethyl-(3-morpholinosulfonylbenzyl)ammonium Formula: C23H33N2O5S+ MolecularWeight: 449.58352

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)CC3=CC(=C(C=C3)OCC)OC

Isomeric SMILES

CC[NH+](CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)CC3=CC(=C(C=C3)OCC)OC

InChI

InChI=1S/C23H32N2O5S/c1-4-24(18-20-9-10-22(30-5-2)23(16-20)28-3)17-19-7-6-8-21(15-19)31(26,27)25-11-13-29-14-12-25/h6-10,15-16H,4-5,11-14,17-18H2,1-3H3/p+1