(3E)-4-ethyl-3-[(1-ethylquinolin-1-ium-2-yl)methylidene]benzo[f]quinoline; 4-methylbenzenesulfonic acid

Systemtic Name: (3E)-4-ethyl-3-[(1-ethylquinolin-1-ium-2-yl)methylidene]benzo[f]quinoline; 4-methylbenzenesulfonic acid Openeye Name: (3E)-4-ethyl-3-[(1-ethylquinolin-1-ium-2-yl)methylene]benzo[f]quinoline; 4-methylbenzenesulfonic acid CAS Name: (3E)-4-ethyl-3-[(1-ethyl-2-quinolin-1-iumyl)methylidene]benzo[f]quinoline; 4-methylbenzenesulfonic acid IUPAC Name: (3E)-4-ethyl-3-[(1-ethylquinolin-1-ium-2-yl)methylidene]benzo[f]quinoline; 4-methylbenzenesulfonic acid Traditional Name: (3E)-4-ethyl-3-[(1-ethylquinolin-1-ium-2-yl)methylene]benzo[f]quinoline; tosylic acid Formula: C34H33N2O3S+ MolecularWeight: 549.70242

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=C1C=CC5=CC=CC=C54.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCN1/C(=C/C2=[N+](C3=CC=CC=C3C=C2)CC)/C=CC4=C1C=CC5=CC=CC=C54.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C27H25N2.C7H8O3S/c1-3-28-22(15-13-21-10-6-8-12-26(21)28)19-23-16-17-25-24-11-7-5-9-20(24)14-18-27(25)29(23)4-2;1-6-2-4-7(5-3-6)11(8,9)10/h5-19H,3-4H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;