dimethyl-[(E)-3-phosphonopentacos-16-en-3-yl]-prop-2-enyl-azanium

Systemtic Name: dimethyl-[(E)-3-phosphonopentacos-16-en-3-yl]-prop-2-enyl-azanium Openeye Name: allyl-[(E)-1-ethyl-1-phosphono-tricos-14-enyl]-dimethyl-ammonium CAS Name: dimethyl-[(E)-3-phosphonopentacos-16-en-3-yl]-prop-2-enylammonium IUPAC Name: dimethyl-[(E)-3-phosphonopentacos-16-en-3-yl]-prop-2-enylazanium Traditional Name: allyl-[(E)-1-ethyl-1-phosphono-tricos-14-enyl]-dimethyl-ammonium Formula: C30H61NO3P+ MolecularWeight: 514.784001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H60NO3P/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30(8-3,35(32,33)34)31(4,5)29-7-2/h7,15-16H,2,6,8-14,17-29H2,1,3-5H3,(H-,32,33,34)/p+1/b16-15+