4-[aminocarbonyl(phenyl)amino]-5-oxidanyl-naphthalene-1,7-disulfonic acid

Systemtic Name: 4-[aminocarbonyl(phenyl)amino]-5-oxidanyl-naphthalene-1,7-disulfonic acid Openeye Name: 4-(N-carbamoylanilino)-5-hydroxy-naphthalene-1,7-disulfonic acid CAS Name: 4-(N-carbamoylanilino)-5-hydroxynaphthalene-1,7-disulfonic acid IUPAC Name: 4-(N-carbamoylanilino)-5-hydroxynaphthalene-1,7-disulfonic acid Traditional Name: 4-(N-carbamoylanilino)-5-hydroxy-naphthalene-1,7-disulfonic acid Formula: C17H14N2O8S2 MolecularWeight: 438.43166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N(C2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)O)C(=O)N

InChI

InChI=1S/C17H14N2O8S2/c18-17(21)19(10-4-2-1-3-5-10)13-6-7-15(29(25,26)27)12-8-11(28(22,23)24)9-14(20)16(12)13/h1-9,20H,(H2,18,21)(H,22,23,24)(H,25,26,27)