[4-(methoxymethyl)acridin-3-yl]-dimethyl-azanium; 4-methylbenzenesulfonate

Systemtic Name: [4-(methoxymethyl)acridin-3-yl]-dimethyl-azanium; 4-methylbenzenesulfonate Openeye Name: [4-(methoxymethyl)acridin-3-yl]-dimethyl-ammonium; 4-methylbenzenesulfonate CAS Name: [4-(methoxymethyl)-3-acridinyl]-dimethylammonium; 4-methylbenzenesulfonate IUPAC Name: [4-(methoxymethyl)acridin-3-yl]-dimethylazanium; 4-methylbenzenesulfonate Traditional Name: [4-(methoxymethyl)acridin-3-yl]-dimethyl-ammonium tosylate Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[NH+](C)C1=C(C2=NC3=CC=CC=C3C=C2C=C1)COC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[NH+](C)C1=C(C2=NC3=CC=CC=C3C=C2C=C1)COC

InChI

InChI=1S/C17H18N2O.C7H8O3S/c1-19(2)16-9-8-13-10-12-6-4-5-7-15(12)18-17(13)14(16)11-20-3;1-6-2-4-7(5-3-6)11(8,9)10/h4-10H,11H2,1-3H3;2-5H,1H3,(H,8,9,10)