azanylidyneoxidanium; but-1-ene; cyclopenta-1,3-diene; rhenium; triphenylphosphanium

Systemtic Name: azanylidyneoxidanium; but-1-ene; cyclopenta-1,3-diene; rhenium; triphenylphosphanium Openeye Name: but-1-ene; cyclopenta-1,3-diene; nitridooxonium; rhenium; triphenylphosphonium CAS Name: 1-butene; cyclopenta-1,3-diene; nitrilooxonium; rhenium; triphenylphosphonium IUPAC Name: azanylidyneoxidanium; but-1-ene; cyclopenta-1,3-diene; rhenium; triphenylphosphanium Traditional Name: but-1-ene; cyclopenta-1,3-diene; nitrilooxonium; rhenium; triphenylphosphonium Formula: C27H28NOPRe MolecularWeight: 599.698081

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]CC=C.[CH-]1C=CC=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.N#[O+].[Re]

Isomeric SMILES

[CH2-]CC=C.[CH-]1C=CC=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.N#[O+].[Re]

InChI

InChI=1S/C18H15P.C5H5.C4H7.NO.Re/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-5-3-1;1-3-4-2;1-2;/h1-15H;1-5H;3H,1-2,4H2;;/q;2*-1;+1;/p+1