azanium 1-[(3E,5E)-7,8-dimethylnona-3,5,7-trienyl]-2-propyl-cycloheptane

Systemtic Name: azanium 1-[(3E,5E)-7,8-dimethylnona-3,5,7-trienyl]-2-propyl-cycloheptane Openeye Name: ammonium 1-[(3E,5E)-7,8-dimethylnona-3,5,7-trienyl]-2-propyl-cycloheptane CAS Name: ammonium 1-[(3E,5E)-7,8-dimethylnona-3,5,7-trienyl]-2-propylcycloheptane IUPAC Name: azanium 1-[(3E,5E)-7,8-dimethylnona-3,5,7-trienyl]-2-propylcycloheptane Traditional Name: ammonium 1-[(3E,5E)-7,8-dimethylnona-3,5,7-trienyl]-2-propyl-cycloheptane Formula: C21H40N+ MolecularWeight: 306.549

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCCCC1CCC=CC=CC(=C(C)C)C.[NH4+]

Isomeric SMILES

CCCC1CCCCCC1CC/C=C/C=C/C(=C(C)C)C.[NH4+]

InChI

InChI=1S/C21H36.H3N/c1-5-13-20-15-11-8-12-17-21(20)16-10-7-6-9-14-19(4)18(2)3;/h6-7,9,14,20-21H,5,8,10-13,15-17H2,1-4H3;1H3/p+1/b7-6+,14-9+;