sodium 2-[[(4-chlorophenyl)sulfonylamino]methyl]-2,3-dihydro-1H-indene-5-carboxylate

Systemtic Name: sodium 2-[[(4-chlorophenyl)sulfonylamino]methyl]-2,3-dihydro-1H-indene-5-carboxylate Openeye Name: sodium 2-[[(4-chlorophenyl)sulfonylamino]methyl]indane-5-carboxylate CAS Name: sodium 2-[[(4-chlorophenyl)sulfonylamino]methyl]-2,3-dihydro-1H-indene-5-carboxylate IUPAC Name: sodium 2-[[(4-chlorophenyl)sulfonylamino]methyl]-2,3-dihydro-1H-indene-5-carboxylate Traditional Name: sodium 2-[[(4-chlorophenyl)sulfonylamino]methyl]indane-5-carboxylate Formula: C17H15ClNNaO4S MolecularWeight: 387.81307

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=C1C=CC(=C2)C(=O)[O-])CNS(=O)(=O)C3=CC=C(C=C3)Cl.[Na+]

Isomeric SMILES

C1C(CC2=C1C=CC(=C2)C(=O)[O-])CNS(=O)(=O)C3=CC=C(C=C3)Cl.[Na+]

InChI

InChI=1S/C17H16ClNO4S.Na/c18-15-3-5-16(6-4-15)24(22,23)19-10-11-7-12-1-2-13(17(20)21)9-14(12)8-11;/h1-6,9,11,19H,7-8,10H2,(H,20,21);/q;+1/p-1