1-butyl-2-[(E,3E)-3-(1-butyl-3,3,5-trimethyl-indol-2-ylidene)prop-1-enyl]quinolin-1-ium

Systemtic Name: 1-butyl-2-[(E,3E)-3-(1-butyl-3,3,5-trimethyl-indol-2-ylidene)prop-1-enyl]quinolin-1-ium Openeye Name: 1-butyl-2-[(E,3E)-3-(1-butyl-3,3,5-trimethyl-indolin-2-ylidene)prop-1-enyl]quinolin-1-ium CAS Name: 1-butyl-2-[(E,3E)-3-(1-butyl-3,3,5-trimethyl-2-indolylidene)prop-1-enyl]quinolin-1-ium IUPAC Name: 1-butyl-2-[(E,3E)-3-(1-butyl-3,3,5-trimethylindol-2-ylidene)prop-1-enyl]quinolin-1-ium Traditional Name: 1-butyl-2-[(E,3E)-3-(1-butyl-3,3,5-trimethyl-indolin-2-ylidene)prop-1-enyl]quinolin-1-ium Formula: C31H39N2+ MolecularWeight: 439.65476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C)C(C1=CC=CC3=[N+](C4=CC=CC=C4C=C3)CCCC)(C)C

Isomeric SMILES

CCCCN\1C2=C(C=C(C=C2)C)C(/C1=C\C=C\C3=[N+](C4=CC=CC=C4C=C3)CCCC)(C)C

InChI

InChI=1S/C31H39N2/c1-6-8-21-32-26(19-18-25-13-10-11-15-28(25)32)14-12-16-30-31(4,5)27-23-24(3)17-20-29(27)33(30)22-9-7-2/h10-20,23H,6-9,21-22H2,1-5H3/q+1