7-oxidanylnaphthalene-1-sulfonic acid; propan-1-amine

Systemtic Name: 7-oxidanylnaphthalene-1-sulfonic acid; propan-1-amine Openeye Name: 7-hydroxynaphthalene-1-sulfonic acid; propan-1-amine CAS Name: 7-hydroxy-1-naphthalenesulfonic acid; 1-propanamine IUPAC Name: 7-hydroxynaphthalene-1-sulfonic acid; propan-1-amine Traditional Name: croceic acid; propylamine Formula: C13H17NO4S MolecularWeight: 283.34338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN.C1=CC2=C(C=C(C=C2)O)C(=C1)S(=O)(=O)O

Isomeric SMILES

CCCN.C1=CC2=C(C=C(C=C2)O)C(=C1)S(=O)(=O)O

InChI

InChI=1S/C10H8O4S.C3H9N/c11-8-5-4-7-2-1-3-10(9(7)6-8)15(12,13)14;1-2-3-4/h1-6,11H,(H,12,13,14);2-4H2,1H3