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3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium

3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium

Systemtic Name:3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium
Openeye Name:3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium
CAS Name:3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium
IUPAC Name:3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium
Traditional Name:3,3-dibutyl-1-[(1E,3E,5E)-hepta-1,3,5-trienyl]indol-1-ium
Formula: C23H32N+
MolecularWeight: 322.50688
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C=[N+](C2=CC=CC=C21)C=CC=CC=CC)CCCC


Isomeric SMILES

CCCCC1(C=[N+](C2=CC=CC=C21)/C=C/C=C/C=C/C)CCCC


InChI

InChI=1S/C23H32N/c1-4-7-10-11-14-19-24-20-23(17-8-5-2,18-9-6-3)21-15-12-13-16-22(21)24/h4,7,10-16,19-20H,5-6,8-9,17-18H2,1-3H3/q+1/b7-4+,11-10+,19-14+


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