3-[(2Z)-2-[(E)-3-(1-methylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]propan-1-ol

Systemtic Name: 3-[(2Z)-2-[(E)-3-(1-methylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]propan-1-ol Openeye Name: 3-[(2Z)-2-[(E)-3-(1-methylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]propan-1-ol CAS Name: 3-[(2Z)-2-[(E)-3-(1-methyl-4-quinolin-1-iumyl)prop-2-enylidene]-1,3-benzothiazol-3-yl]-1-propanol IUPAC Name: 3-[(2Z)-2-[(E)-3-(1-methylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]propan-1-ol Traditional Name: 3-[(2Z)-2-[(E)-3-(1-methylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]propan-1-ol Formula: C23H23N2OS+ MolecularWeight: 375.50652

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C2=CC=CC=C21)C=CC=C3N(C4=CC=CC=C4S3)CCCO

Isomeric SMILES

C[N+]1=CC=C(C2=CC=CC=C21)/C=C/C=C\3/N(C4=CC=CC=C4S3)CCCO

InChI

InChI=1S/C23H23N2OS/c1-24-16-14-18(19-9-2-3-10-20(19)24)8-6-13-23-25(15-7-17-26)21-11-4-5-12-22(21)27-23/h2-6,8-14,16,26H,7,15,17H2,1H3/q+1