[(E)-icos-11-enyl]-bis(4-methylhexan-3-yl)-phosphono-azanium

Systemtic Name: [(E)-icos-11-enyl]-bis(4-methylhexan-3-yl)-phosphono-azanium Openeye Name: bis(1-ethyl-2-methyl-butyl)-[(E)-icos-11-enyl]-phosphono-ammonium CAS Name: [(E)-eicos-11-enyl]-bis(4-methylhexan-3-yl)-phosphonoammonium IUPAC Name: [(E)-icos-11-enyl]-bis(4-methylhexan-3-yl)-phosphonoazanium Traditional Name: [(E)-eicos-11-enyl]-bis(1-ethyl-2-methyl-butyl)-phosphono-ammonium Formula: C34H71NO3P+ MolecularWeight: 572.906201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCC[N+](C(CC)C(C)CC)(C(CC)C(C)CC)P(=O)(O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCC[N+](C(CC)C(C)CC)(C(CC)C(C)CC)P(=O)(O)O

InChI

InChI=1S/C34H70NO3P/c1-8-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-35(39(36,37)38,33(11-4)31(6)9-2)34(12-5)32(7)10-3/h19-20,31-34H,8-18,21-30H2,1-7H3,(H-,36,37,38)/p+1/b20-19+