[(E)-1-(2,2-dimethylpropanoylamino)-2-morpholin-4-yl-ethenyl]-triphenyl-phosphanium iodide

Systemtic Name: [(E)-1-(2,2-dimethylpropanoylamino)-2-morpholin-4-yl-ethenyl]-triphenyl-phosphanium iodide Openeye Name: [(E)-1-(2,2-dimethylpropanoylamino)-2-morpholino-vinyl]-triphenyl-phosphonium iodide CAS Name: [(E)-1-[(2,2-dimethyl-1-oxopropyl)amino]-2-(4-morpholinyl)ethenyl]-triphenylphosphonium iodide IUPAC Name: [(E)-1-(2,2-dimethylpropanoylamino)-2-morpholin-4-ylethenyl]-triphenylphosphanium iodide Traditional Name: [(E)-2-morpholino-1-(pivaloylamino)vinyl]-triphenyl-phosphonium iodide Formula: C29H34IN2O2P MolecularWeight: 600.470691

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=CN1CCOCC1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

CC(C)(C)C(=O)N/C(=C\N1CCOCC1)/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C29H33N2O2P.HI/c1-29(2,3)28(32)30-27(23-31-19-21-33-22-20-31)34(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26;/h4-18,23H,19-22H2,1-3H3;1H/b27-23+;