2,3-dibutoxy-4-octyl-1-oxidanidyl-quinolin-1-ium

Systemtic Name: 2,3-dibutoxy-4-octyl-1-oxidanidyl-quinolin-1-ium Openeye Name: 2,3-dibutoxy-4-octyl-1-oxido-quinolin-1-ium CAS Name: 2,3-dibutoxy-4-octyl-1-oxidoquinolin-1-ium IUPAC Name: 2,3-dibutoxy-4-octyl-1-oxidoquinolin-1-ium Traditional Name: 2,3-dibutoxy-4-octyl-1-oxido-quinolin-1-ium Formula: C25H39NO3 MolecularWeight: 401.58206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=[N+](C2=CC=CC=C21)[O-])OCCCC)OCCCC

Isomeric SMILES

CCCCCCCCC1=C(C(=[N+](C2=CC=CC=C21)[O-])OCCCC)OCCCC

InChI

InChI=1S/C25H39NO3/c1-4-7-10-11-12-13-17-22-21-16-14-15-18-23(21)26(27)25(29-20-9-6-3)24(22)28-19-8-5-2/h14-16,18H,4-13,17,19-20H2,1-3H3