4-[3-[(E)-2-(1,3-benzothiazol-3-ium-2-yl)ethenyl]quinolin-2-yl]morpholine

Systemtic Name: 4-[3-[(E)-2-(1,3-benzothiazol-3-ium-2-yl)ethenyl]quinolin-2-yl]morpholine Openeye Name: 4-[3-[(E)-2-(1,3-benzothiazol-3-ium-2-yl)vinyl]-2-quinolyl]morpholine CAS Name: 4-[3-[(E)-2-(1,3-benzothiazol-3-ium-2-yl)ethenyl]-2-quinolinyl]morpholine IUPAC Name: 4-[3-[(E)-2-(1,3-benzothiazol-3-ium-2-yl)ethenyl]quinolin-2-yl]morpholine Traditional Name: 4-[3-[(E)-2-(1,3-benzothiazol-3-ium-2-yl)vinyl]-2-quinolyl]morpholine Formula: C22H20N3OS+ MolecularWeight: 374.4787

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3C=C2C=CC4=[NH+]C5=CC=CC=C5S4

Isomeric SMILES

C1COCCN1C2=NC3=CC=CC=C3C=C2/C=C/C4=[NH+]C5=CC=CC=C5S4

InChI

InChI=1S/C22H19N3OS/c1-2-6-18-16(5-1)15-17(22(24-18)25-11-13-26-14-12-25)9-10-21-23-19-7-3-4-8-20(19)27-21/h1-10,15H,11-14H2/p+1/b10-9+