(1-isoquinolin-1-ylnaphthalen-2-yl)-diphenyl-phosphane; tricyclohexylphosphane; tris(2-methylphenyl)phosphane

Systemtic Name: (1-isoquinolin-1-ylnaphthalen-2-yl)-diphenyl-phosphane; tricyclohexylphosphane; tris(2-methylphenyl)phosphane Openeye Name: [1-(1-isoquinolyl)-2-naphthyl]-diphenyl-phosphane; tricyclohexylphosphane; tris-o-tolylphosphane CAS Name: [1-(1-isoquinolinyl)-2-naphthalenyl]-diphenylphosphine; tricyclohexylphosphine; tris(2-methylphenyl)phosphine IUPAC Name: (1-isoquinolin-1-ylnaphthalen-2-yl)-diphenylphosphane; tricyclohexylphosphane; tris(2-methylphenyl)phosphane Traditional Name: [1-(1-isoquinolyl)-2-naphthyl]-diphenyl-phosphine; tricyclohexylphosphine; tris-o-tolylphosphine Formula: C70H76NP3 MolecularWeight: 1024.280423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=NC=CC6=CC=CC=C65

Isomeric SMILES

CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=NC=CC6=CC=CC=C65

InChI

InChI=1S/C31H22NP.C21H21P.C18H33P/c1-3-13-25(14-4-1)33(26-15-5-2-6-16-26)29-20-19-23-11-7-9-17-27(23)30(29)31-28-18-10-8-12-24(28)21-22-32-31;1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-22H;4-15H,1-3H3;16-18H,1-15H2