5-methoxy-7-sulfo-4-(trimethylazaniumyl)naphthalene-2-sulfonate

Systemtic Name: 5-methoxy-7-sulfo-4-(trimethylazaniumyl)naphthalene-2-sulfonate Openeye Name: 5-methoxy-7-sulfo-4-(trimethylammonio)naphthalene-2-sulfonate CAS Name: 5-methoxy-7-sulfo-4-(trimethylammonio)-2-naphthalenesulfonate IUPAC Name: 5-methoxy-7-sulfo-4-(trimethylazaniumyl)naphthalene-2-sulfonate Traditional Name: 5-methoxy-7-sulfo-4-(trimethylammonio)naphthalene-2-sulfonate Formula: C14H17NO7S2 MolecularWeight: 375.41728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(C=C2OC)S(=O)(=O)O

Isomeric SMILES

C[N+](C)(C)C1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(C=C2OC)S(=O)(=O)O

InChI

InChI=1S/C14H17NO7S2/c1-15(2,3)12-7-10(23(16,17)18)5-9-6-11(24(19,20)21)8-13(22-4)14(9)12/h5-8H,1-4H3,(H-,16,17,18,19,20,21)