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

Systemtic Name: sodium 4-[(4-chlorophenyl)carbonylamino]-3-(4-ethylphenyl)naphthalene-1-sulfonate Openeye Name: sodium 4-[(4-chlorobenzoyl)amino]-3-(4-ethylphenyl)naphthalene-1-sulfonate CAS Name: sodium 4-[[(4-chlorophenyl)-oxomethyl]amino]-3-(4-ethylphenyl)-1-naphthalenesulfonate IUPAC Name: sodium 4-[(4-chlorobenzoyl)amino]-3-(4-ethylphenyl)naphthalene-1-sulfonate Traditional Name: sodium 4-[(4-chlorobenzoyl)amino]-3-(4-ethylphenyl)naphthalene-1-sulfonate Formula: C25H19ClNNaO4S MolecularWeight: 487.93043

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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)Cl.[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)Cl.[Na+]

InChI

InChI=1S/C25H20ClNO4S.Na/c1-2-16-7-9-17(10-8-16)22-15-23(32(29,30)31)20-5-3-4-6-21(20)24(22)27-25(28)18-11-13-19(26)14-12-18;/h3-15H,2H2,1H3,(H,27,28)(H,29,30,31);/q;+1/p-1