2-(2-chloranylacridin-9-yl)sulfanylethanoate; diethyl(2-hydroxyethyl)azanium

Systemtic Name: 2-(2-chloranylacridin-9-yl)sulfanylethanoate; diethyl(2-hydroxyethyl)azanium Openeye Name: 2-(2-chloroacridin-9-yl)sulfanylacetate; diethyl(2-hydroxyethyl)ammonium CAS Name: 2-[(2-chloro-9-acridinyl)thio]acetate; diethyl(2-hydroxyethyl)ammonium IUPAC Name: 2-(2-chloroacridin-9-yl)sulfanylacetate; diethyl(2-hydroxyethyl)azanium Traditional Name: 2-[(2-chloroacridin-9-yl)thio]acetate; diethyl(2-hydroxyethyl)ammonium Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCO.C1=CC=C2C(=C1)C(=C3C=C(C=CC3=N2)Cl)SCC(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCO.C1=CC=C2C(=C1)C(=C3C=C(C=CC3=N2)Cl)SCC(=O)[O-]

InChI

InChI=1S/C15H10ClNO2S.C6H15NO/c16-9-5-6-13-11(7-9)15(20-8-14(18)19)10-3-1-2-4-12(10)17-13;1-3-7(4-2)5-6-8/h1-7H,8H2,(H,18,19);8H,3-6H2,1-2H3