1-ethyl-4-[(E,3E)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]quinolin-1-ium iodide

Systemtic Name: 1-ethyl-4-[(E,3E)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]quinolin-1-ium iodide Openeye Name: 1-ethyl-4-[(E,3E)-3-(1,3,3-trimethylindolin-2-ylidene)prop-1-enyl]quinolin-1-ium iodide CAS Name: 1-ethyl-4-[(E,3E)-3-(1,3,3-trimethyl-2-indolylidene)prop-1-enyl]quinolin-1-ium iodide IUPAC Name: 1-ethyl-4-[(E,3E)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]quinolin-1-ium iodide Traditional Name: 1-ethyl-4-[(E,3E)-3-(1,3,3-trimethylindolin-2-ylidene)prop-1-enyl]quinolin-1-ium iodide Formula: C25H27IN2 MolecularWeight: 482.39975

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C2=CC=CC=C21)C=CC=C3C(C4=CC=CC=C4N3C)(C)C.[I-]

Isomeric SMILES

CC[N+]1=CC=C(C2=CC=CC=C21)/C=C/C=C/3\C(C4=CC=CC=C4N3C)(C)C.[I-]

InChI

InChI=1S/C25H27N2.HI/c1-5-27-18-17-19(20-12-6-8-14-22(20)27)11-10-16-24-25(2,3)21-13-7-9-15-23(21)26(24)4;/h6-18H,5H2,1-4H3;1H/q+1;/p-1