1-methanidyloxy-3-nitro-benzene-6-ide; palladium(2+); triphenylphosphane

Systemtic Name: 1-methanidyloxy-3-nitro-benzene-6-ide; palladium(2+); triphenylphosphane Openeye Name: 1-methanidyloxy-3-nitro-benzene-6-ide; palladium(2+); triphenylphosphane CAS Name: 1-methanidyloxy-3-nitrobenzene-6-ide; palladium(2+); triphenylphosphine IUPAC Name: 1-methanidyloxy-3-nitrobenzene-6-ide; palladium(2+); triphenylphosphane Traditional Name: 1-methanidyloxy-3-nitro-benzene-6-ide; palladium(2+); triphenylphosphine Formula: C43H35NO3P2Pd MolecularWeight: 782.110422

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]OC1=CC(=CC=[C-]1)[N+](=O)[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd+2]

Isomeric SMILES

[CH2-]OC1=CC(=CC=[C-]1)[N+](=O)[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd+2]

InChI

InChI=1S/2C18H15P.C7H5NO3.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-11-7-4-2-3-6(5-7)8(9)10;/h2*1-15H;2-3,5H,1H2;/q;;-2;+2