sodium 7-[(4-cyanophenyl)methoxy]naphthalene-2-sulfonate

Systemtic Name: sodium 7-[(4-cyanophenyl)methoxy]naphthalene-2-sulfonate Openeye Name: sodium 7-[(4-cyanophenyl)methoxy]naphthalene-2-sulfonate CAS Name: sodium 7-[(4-cyanophenyl)methoxy]-2-naphthalenesulfonate IUPAC Name: sodium 7-[(4-cyanophenyl)methoxy]naphthalene-2-sulfonate Traditional Name: sodium 7-(4-cyanobenzyl)oxynaphthalene-2-sulfonate Formula: C18H12NNaO4S MolecularWeight: 361.34695

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])OCC3=CC=C(C=C3)C#N.[Na+]

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])OCC3=CC=C(C=C3)C#N.[Na+]

InChI

InChI=1S/C18H13NO4S.Na/c19-11-13-1-3-14(4-2-13)12-23-17-7-5-15-6-8-18(24(20,21)22)10-16(15)9-17;/h1-10H,12H2,(H,20,21,22);/q;+1/p-1