sodium 2-(10-cyclopropyl-9-oxidanylidene-acridin-2-yl)sulfanylethanoate

Systemtic Name: sodium 2-(10-cyclopropyl-9-oxidanylidene-acridin-2-yl)sulfanylethanoate Openeye Name: sodium 2-(10-cyclopropyl-9-oxo-acridin-2-yl)sulfanylacetate CAS Name: sodium 2-[(10-cyclopropyl-9-oxo-2-acridinyl)thio]acetate IUPAC Name: sodium 2-(10-cyclopropyl-9-oxoacridin-2-yl)sulfanylacetate Traditional Name: sodium 2-[(10-cyclopropyl-9-keto-acridin-2-yl)thio]acetate Formula: C18H14NNaO3S MolecularWeight: 347.36343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C=C(C=C3)SCC(=O)[O-])C(=O)C4=CC=CC=C42.[Na+]

Isomeric SMILES

C1CC1N2C3=C(C=C(C=C3)SCC(=O)[O-])C(=O)C4=CC=CC=C42.[Na+]

InChI

InChI=1S/C18H15NO3S.Na/c20-17(21)10-23-12-7-8-16-14(9-12)18(22)13-3-1-2-4-15(13)19(16)11-5-6-11;/h1-4,7-9,11H,5-6,10H2,(H,20,21);/q;+1/p-1