[2-(2-azanylethanoyloxy)-4-(2-azanyl-6-prop-2-enoyl-3-sulfamoyl-phenyl)phenyl] 2-azanylethanoate dihydrochloride

Systemtic Name: [2-(2-azanylethanoyloxy)-4-(2-azanyl-6-prop-2-enoyl-3-sulfamoyl-phenyl)phenyl] 2-azanylethanoate dihydrochloride Openeye Name: [2-(2-aminoacetyl)oxy-4-(2-amino-6-prop-2-enoyl-3-sulfamoyl-phenyl)phenyl] 2-aminoacetate dihydrochloride CAS Name: 2-aminoacetic acid [2-(2-amino-1-oxoethoxy)-4-[2-amino-6-(1-oxoprop-2-enyl)-3-sulfamoylphenyl]phenyl] ester dihydrochloride IUPAC Name: [2-(2-aminoacetyl)oxy-4-(2-amino-6-prop-2-enoyl-3-sulfamoylphenyl)phenyl] 2-aminoacetate dihydrochloride Traditional Name: 2-aminoacetic acid [4-(6-acryloyl-2-amino-3-sulfamoyl-phenyl)-2-glycyloxy-phenyl] ester dihydrochloride Formula: C19H22Cl2N4O7S MolecularWeight: 521.37158

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)C1=C(C(=C(C=C1)S(=O)(=O)N)N)C2=CC(=C(C=C2)OC(=O)CN)OC(=O)CN.Cl.Cl

Isomeric SMILES

C=CC(=O)C1=C(C(=C(C=C1)S(=O)(=O)N)N)C2=CC(=C(C=C2)OC(=O)CN)OC(=O)CN.Cl.Cl

InChI

InChI=1S/C19H20N4O7S.2ClH/c1-2-12(24)11-4-6-15(31(23,27)28)19(22)18(11)10-3-5-13(29-16(25)8-20)14(7-10)30-17(26)9-21;;/h2-7H,1,8-9,20-22H2,(H2,23,27,28);2*1H