(2-carboxyphenyl)carbonyl-[4-(1,3-thiazol-2-ylazaniumyl)sulfonylphenyl]azanium

Systemtic Name: (2-carboxyphenyl)carbonyl-[4-(1,3-thiazol-2-ylazaniumyl)sulfonylphenyl]azanium Openeye Name: (2-carboxybenzoyl)-[4-(thiazol-2-ylammonio)sulfonylphenyl]ammonium CAS Name: [(2-carboxyphenyl)-oxomethyl]-[4-(2-thiazolylammonio)sulfonylphenyl]ammonium IUPAC Name: (2-carboxybenzoyl)-[4-(1,3-thiazol-2-ylazaniumyl)sulfonylphenyl]azanium Traditional Name: (2-carboxybenzoyl)-[4-(thiazol-2-ylammonio)sulfonylphenyl]ammonium Formula: C17H15N3O5S2+2 MolecularWeight: 405.4481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[NH2+]C2=CC=C(C=C2)S(=O)(=O)[NH2+]C3=NC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[NH2+]C2=CC=C(C=C2)S(=O)(=O)[NH2+]C3=NC=CS3)C(=O)O

InChI

InChI=1S/C17H13N3O5S2/c21-15(13-3-1-2-4-14(13)16(22)23)19-11-5-7-12(8-6-11)27(24,25)20-17-18-9-10-26-17/h1-10H,(H,18,20)(H,19,21)(H,22,23)/p+2