aniline; 7-oxidanylnaphthalene-1,3-disulfonic acid

Systemtic Name: aniline; 7-oxidanylnaphthalene-1,3-disulfonic acid Openeye Name: aniline; 7-hydroxynaphthalene-1,3-disulfonic acid CAS Name: aniline; 7-hydroxynaphthalene-1,3-disulfonic acid IUPAC Name: aniline; 7-hydroxynaphthalene-1,3-disulfonic acid Traditional Name: 7-hydroxynaphthalene-1,3-disulfonic acid; phenylamine Formula: C16H15NO7S2 MolecularWeight: 397.4228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N.C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)N.C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C10H8O7S2.C6H7N/c11-7-2-1-6-3-8(18(12,13)14)5-10(9(6)4-7)19(15,16)17;7-6-4-2-1-3-5-6/h1-5,11H,(H,12,13,14)(H,15,16,17);1-5H,7H2