N2,N3-bis[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]butane-2,3-diimine

Systemtic Name: N2,N3-bis[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]butane-2,3-diimine Openeye Name: N2,N3-bis[1-(2-diphenylphosphanyl-1-naphthyl)-2-naphthyl]butane-2,3-diimine CAS Name: N2,N3-bis[1-(2-diphenylphosphino-1-naphthalenyl)-2-naphthalenyl]butane-2,3-diimine IUPAC Name: 2-N,3-N-bis[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]butane-2,3-diimine Traditional Name: [1-(2-diphenylphosphino-1-naphthyl)-2-naphthyl]-[2-[[1-(2-diphenylphosphino-1-naphthyl)-2-naphthyl]imino]-1-methyl-propylidene]amine Formula: C68H50N2P2 MolecularWeight: 957.085522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)P(C5=CC=CC=C5)C6=CC=CC=C6)C(=NC7=C(C8=CC=CC=C8C=C7)C9=C(C=CC1=CC=CC=C19)P(C1=CC=CC=C1)C1=CC=CC=C1)C

Isomeric SMILES

CC(=NC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)P(C5=CC=CC=C5)C6=CC=CC=C6)C(=NC7=C(C8=CC=CC=C8C=C7)C9=C(C=CC1=CC=CC=C19)P(C1=CC=CC=C1)C1=CC=CC=C1)C

InChI

InChI=1S/C68H50N2P2/c1-47(69-61-43-39-49-23-15-19-35-57(49)65(61)67-59-37-21-17-25-51(59)41-45-63(67)71(53-27-7-3-8-28-53)54-29-9-4-10-30-54)48(2)70-62-44-40-50-24-16-20-36-58(50)66(62)68-60-38-22-18-26-52(60)42-46-64(68)72(55-31-11-5-12-32-55)56-33-13-6-14-34-56/h3-46H,1-2H3