sodium 3-(4-ethylphenyl)-4-[(4-methylphenyl)carbonylamino]naphthalene-1-sulfonate

Systemtic Name: sodium 3-(4-ethylphenyl)-4-[(4-methylphenyl)carbonylamino]naphthalene-1-sulfonate Openeye Name: sodium 3-(4-ethylphenyl)-4-[(4-methylbenzoyl)amino]naphthalene-1-sulfonate CAS Name: sodium 3-(4-ethylphenyl)-4-[[(4-methylphenyl)-oxomethyl]amino]-1-naphthalenesulfonate IUPAC Name: sodium 3-(4-ethylphenyl)-4-[(4-methylbenzoyl)amino]naphthalene-1-sulfonate Traditional Name: sodium 3-(4-ethylphenyl)-4-(p-toluoylamino)naphthalene-1-sulfonate Formula: C26H22NNaO4S MolecularWeight: 467.51195

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C3=CC=CC=C3C(=C2)S(=O)(=O)[O-])NC(=O)C4=CC=C(C=C4)C.[Na+]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C3=CC=CC=C3C(=C2)S(=O)(=O)[O-])NC(=O)C4=CC=C(C=C4)C.[Na+]

InChI

InChI=1S/C26H23NO4S.Na/c1-3-18-10-14-19(15-11-18)23-16-24(32(29,30)31)21-6-4-5-7-22(21)25(23)27-26(28)20-12-8-17(2)9-13-20;/h4-16H,3H2,1-2H3,(H,27,28)(H,29,30,31);/q;+1/p-1