2-(2-ethoxyphenoxy)ethyl-[(2S)-1-(4-methoxy-3-sulfamoyl-phenyl)propan-2-yl]azanium

Systemtic Name: 2-(2-ethoxyphenoxy)ethyl-[(2S)-1-(4-methoxy-3-sulfamoyl-phenyl)propan-2-yl]azanium Openeye Name: 2-(2-ethoxyphenoxy)ethyl-[(1S)-2-(4-methoxy-3-sulfamoyl-phenyl)-1-methyl-ethyl]ammonium CAS Name: 2-(2-ethoxyphenoxy)ethyl-[(2S)-1-(4-methoxy-3-sulfamoylphenyl)propan-2-yl]ammonium IUPAC Name: 2-(2-ethoxyphenoxy)ethyl-[(2S)-1-(4-methoxy-3-sulfamoylphenyl)propan-2-yl]azanium Traditional Name: 2-(2-ethoxyphenoxy)ethyl-[(1S)-2-(4-methoxy-3-sulfamoyl-phenyl)-1-methyl-ethyl]ammonium Formula: C20H29N2O5S+ MolecularWeight: 409.51966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCC[NH2+]C(C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N

Isomeric SMILES

CCOC1=CC=CC=C1OCC[NH2+][C@@H](C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N

InChI

InChI=1S/C20H28N2O5S/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24)/p+1/t15-/m0/s1