(2Z)-2-[(E)-3-(3,3-dimethyl-1-tetradecyl-indol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethyl-1-tetradecyl-indole

Systemtic Name: (2Z)-2-[(E)-3-(3,3-dimethyl-1-tetradecyl-indol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethyl-1-tetradecyl-indole Openeye Name: 2-[(E,3Z)-3-(3,3-dimethyl-1-tetradecyl-indolin-2-ylidene)prop-1-enyl]-3,3-dimethyl-1-tetradecyl-indol-1-ium CAS Name: (2Z)-2-[(E)-3-(3,3-dimethyl-1-tetradecyl-2-indol-1-iumyl)prop-2-enylidene]-3,3-dimethyl-1-tetradecylindole IUPAC Name: (2Z)-2-[(E)-3-(3,3-dimethyl-1-tetradecylindol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethyl-1-tetradecylindole Traditional Name: 2-[(E,3Z)-3-(3,3-dimethyl-1-myristyl-indolin-2-ylidene)prop-1-enyl]-3,3-dimethyl-1-myristyl-indol-1-ium Formula: C51H81N2+ MolecularWeight: 722.20224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCN1C2=CC=CC=C2C(C1=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CCCCCCCCCCCCCC)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCN\1C2=CC=CC=C2C(/C1=C/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)CCCCCCCCCCCCCC)(C)C

InChI

InChI=1S/C51H81N2/c1-7-9-11-13-15-17-19-21-23-25-27-33-42-52-46-38-31-29-36-44(46)50(3,4)48(52)40-35-41-49-51(5,6)45-37-30-32-39-47(45)53(49)43-34-28-26-24-22-20-18-16-14-12-10-8-2/h29-32,35-41H,7-28,33-34,42-43H2,1-6H3/q+1