[4-[6-(2-methylbutanoyloxy)hexoxy]phenyl]-methylidyne-azanium

Systemtic Name: [4-[6-(2-methylbutanoyloxy)hexoxy]phenyl]-methylidyne-azanium Openeye Name: [4-[6-(2-methylbutanoyloxy)hexoxy]phenyl]-methylidyne-ammonium CAS Name: methylidyne-[4-[6-(2-methyl-1-oxobutoxy)hexoxy]phenyl]ammonium IUPAC Name: [4-[6-(2-methylbutanoyloxy)hexoxy]phenyl]-methylidyneazanium Traditional Name: [4-[6-(2-methylbutanoyloxy)hexoxy]phenyl]-methylidyne-ammonium Formula: C18H26NO3+ MolecularWeight: 304.40394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCCCCCCOC1=CC=C(C=C1)[N+]#C

Isomeric SMILES

CCC(C)C(=O)OCCCCCCOC1=CC=C(C=C1)[N+]#C

InChI

InChI=1S/C18H26NO3/c1-4-15(2)18(20)22-14-8-6-5-7-13-21-17-11-9-16(19-3)10-12-17/h3,9-12,15H,4-8,13-14H2,1-2H3/q+1