(4-carboxyphenyl)sulfonyl-[4-(4-chloranyl-3-oxidanyl-phenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]-methyl-propyl-azanium

Systemtic Name: (4-carboxyphenyl)sulfonyl-[4-(4-chloranyl-3-oxidanyl-phenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]-methyl-propyl-azanium Openeye Name: (4-carboxyphenyl)sulfonyl-[4-(4-chloro-3-hydroxy-phenyl)-5-(4-pyridyl)-1H-imidazol-2-yl]-methyl-propyl-ammonium CAS Name: (4-carboxyphenyl)sulfonyl-[4-(4-chloro-3-hydroxyphenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]-methyl-propylammonium IUPAC Name: (4-carboxyphenyl)sulfonyl-[4-(4-chloro-3-hydroxyphenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]-methyl-propylazanium Traditional Name: (4-carboxyphenyl)sulfonyl-[4-(4-chloro-3-hydroxy-phenyl)-5-(4-pyridyl)-1H-imidazol-2-yl]-methyl-propyl-ammonium Formula: C25H24ClN4O5S+ MolecularWeight: 527.99986

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C1=NC(=C(N1)C2=CC=NC=C2)C3=CC(=C(C=C3)Cl)O)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCC[N+](C)(C1=NC(=C(N1)C2=CC=NC=C2)C3=CC(=C(C=C3)Cl)O)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H23ClN4O5S/c1-3-14-30(2,36(34,35)19-7-4-17(5-8-19)24(32)33)25-28-22(16-10-12-27-13-11-16)23(29-25)18-6-9-20(26)21(31)15-18/h4-13,15H,3,14H2,1-2H3,(H2-,27,28,29,31,32,33)/p+1