2-[(Z)-2-chloranyl-2-thiophen-2-yl-ethenyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium

Systemtic Name: 2-[(Z)-2-chloranyl-2-thiophen-2-yl-ethenyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium Openeye Name: 2-[(Z)-2-chloro-2-(2-thienyl)vinyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium CAS Name: 2-[(Z)-2-chloro-2-thiophen-2-ylethenyl]-1-methylbenzo[e][1,3]benzothiazol-1-ium IUPAC Name: 2-[(Z)-2-chloro-2-thiophen-2-ylethenyl]-1-methylbenzo[e][1,3]benzothiazol-1-ium Traditional Name: 2-[(Z)-2-chloro-2-(2-thienyl)vinyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium Formula: C18H13ClNS2+ MolecularWeight: 342.88552

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C=C(C4=CC=CS4)Cl

Isomeric SMILES

C[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C(/C4=CC=CS4)\Cl

InChI

InChI=1S/C18H13ClNS2/c1-20-17(11-14(19)15-7-4-10-21-15)22-16-9-8-12-5-2-3-6-13(12)18(16)20/h2-11H,1H3/q+1/b14-11-