9-methyl-7-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]purin-9-ium-6-amine

Systemtic Name: 9-methyl-7-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]purin-9-ium-6-amine Openeye Name: 9-methyl-7-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]purin-9-ium-6-amine CAS Name: 9-methyl-7-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]-6-purin-9-iumamine IUPAC Name: 9-methyl-7-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]purin-9-ium-6-amine Traditional Name: [9-methyl-7-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]purin-9-ium-6-yl]amine Formula: C26H46N5+ MolecularWeight: 428.67694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(=CCN1C=[N+](C2=C1C(=NC=N2)N)C)C

Isomeric SMILES

CC(C)CCCC(C)CCCC(C)CCC/C(=C/CN1C=[N+](C2=C1C(=NC=N2)N)C)/C

InChI

InChI=1S/C26H46N5/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-17-31-19-30(6)26-24(31)25(27)28-18-29-26/h16,18-22H,7-15,17H2,1-6H3,(H2,27,28,29)/q+1/b23-16+