[(E)-1-oxidanylidene-1-phenyl-3-[(phenylmethyl)amino]but-2-en-2-yl]-phenyl-iodanium

Systemtic Name: [(E)-1-oxidanylidene-1-phenyl-3-[(phenylmethyl)amino]but-2-en-2-yl]-phenyl-iodanium Openeye Name: [(E)-1-benzoyl-2-(benzylamino)prop-1-enyl]-phenyl-iodonium CAS Name: [(E)-1-oxo-1-phenyl-3-[(phenylmethyl)amino]but-2-en-2-yl]-phenyliodonium IUPAC Name: [(E)-3-(benzylamino)-1-oxo-1-phenylbut-2-en-2-yl]-phenyliodanium Traditional Name: [(E)-1-benzoyl-2-(benzylamino)prop-1-enyl]-phenyl-iodonium Formula: C23H21INO+ MolecularWeight: 454.32341

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C1=CC=CC=C1)[I+]C2=CC=CC=C2)NCC3=CC=CC=C3

Isomeric SMILES

C/C(=C(/C(=O)C1=CC=CC=C1)\[I+]C2=CC=CC=C2)/NCC3=CC=CC=C3

InChI

InChI=1S/C23H20INO/c1-18(25-17-19-11-5-2-6-12-19)22(24-21-15-9-4-10-16-21)23(26)20-13-7-3-8-14-20/h2-16H,17H2,1H3/p+1