N-[(E)-2-(9H-carbazol-9-ium-9-yl)ethenyl]aniline; 4-methylbenzenesulfonate

Systemtic Name: N-[(E)-2-(9H-carbazol-9-ium-9-yl)ethenyl]aniline; 4-methylbenzenesulfonate Openeye Name: N-[(E)-2-(9H-carbazol-9-ium-9-yl)vinyl]aniline; 4-methylbenzenesulfonate CAS Name: N-[(E)-2-(9H-carbazol-9-ium-9-yl)ethenyl]aniline; 4-methylbenzenesulfonate IUPAC Name: N-[(E)-2-(9H-carbazol-9-ium-9-yl)ethenyl]aniline; 4-methylbenzenesulfonate Traditional Name: [(E)-2-(9H-carbazol-9-ium-9-yl)vinyl]-phenyl-amine tosylate Formula: C27H24N2O3S MolecularWeight: 456.55606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)NC=C[NH+]2C3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)N/C=C/[NH+]2C3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C20H16N2.C7H8O3S/c1-2-8-16(9-3-1)21-14-15-22-19-12-6-4-10-17(19)18-11-5-7-13-20(18)22;1-6-2-4-7(5-3-6)11(8,9)10/h1-15,21H;2-5H,1H3,(H,8,9,10)/b15-14+;