7-(methylamino)naphthalene-1,3,5-trisulfonic acid

Systemtic Name: 7-(methylamino)naphthalene-1,3,5-trisulfonic acid Openeye Name: 7-(methylamino)naphthalene-1,3,5-trisulfonic acid CAS Name: 7-(methylamino)naphthalene-1,3,5-trisulfonic acid IUPAC Name: 7-(methylamino)naphthalene-1,3,5-trisulfonic acid Traditional Name: 7-(methylamino)naphthalene-1,3,5-trisulfonic acid Formula: C11H11NO9S3 MolecularWeight: 397.40134

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=C2C=C(C=C(C2=C1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CNC1=CC(=C2C=C(C=C(C2=C1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C11H11NO9S3/c1-12-6-2-8-9(10(3-6)23(16,17)18)4-7(22(13,14)15)5-11(8)24(19,20)21/h2-5,12H,1H3,(H,13,14,15)(H,16,17,18)(H,19,20,21)