6-chloranyl-3-[(E)-2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]chromen-4-one

Systemtic Name: 6-chloranyl-3-[(E)-2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]chromen-4-one Openeye Name: 6-chloro-3-[(E)-2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)vinyl]chromen-4-one CAS Name: 6-chloro-3-[(E)-2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-1-benzopyran-4-one IUPAC Name: 6-chloro-3-[(E)-2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]chromen-4-one Traditional Name: 6-chloro-3-[(E)-2-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)vinyl]chromone Formula: C20H15ClNO2S+ MolecularWeight: 368.8566

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=CC=CC=C21)C=CC3=COC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

CC[N+]1=C(SC2=CC=CC=C21)/C=C/C3=COC4=C(C3=O)C=C(C=C4)Cl

InChI

InChI=1S/C20H15ClNO2S/c1-2-22-16-5-3-4-6-18(16)25-19(22)10-7-13-12-24-17-9-8-14(21)11-15(17)20(13)23/h3-12H,2H2,1H3/q+1/b10-7+