[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-[2-(4-sulfamoylphenyl)ethyl]azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-[2-(4-sulfamoylphenyl)ethyl]azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-[2-(4-sulfamoylphenyl)ethyl]ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-[2-(4-sulfamoylphenyl)ethyl]ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-[2-(4-sulfamoylphenyl)ethyl]azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-[2-(4-sulfamoylphenyl)ethyl]ammonium Formula: C18H24N3O5S+ MolecularWeight: 394.46526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)N)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)N)OCC(=O)N

InChI

InChI=1S/C18H23N3O5S/c1-25-17-10-14(4-7-16(17)26-12-18(19)22)11-21-9-8-13-2-5-15(6-3-13)27(20,23)24/h2-7,10,21H,8-9,11-12H2,1H3,(H2,19,22)(H2,20,23,24)/p+1