tris(chloranyl)chromium; tris(4-methylphenyl) phosphate

Systemtic Name: tris(chloranyl)chromium; tris(4-methylphenyl) phosphate Openeye Name: trichlorochromium; tris-p-tolyl phosphate CAS Name: phosphoric acid tris(4-methylphenyl) ester; trichlorochromium IUPAC Name: trichlorochromium; tris(4-methylphenyl) phosphate Traditional Name: phosphoric acid tris-p-tolyl ester; trichlorochromium Formula: C42H42Cl3CrO8P2 MolecularWeight: 895.080702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.Cl[Cr](Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.Cl[Cr](Cl)Cl

InChI

InChI=1S/2C21H21O4P.3ClH.Cr/c2*1-16-4-10-19(11-5-16)23-26(22,24-20-12-6-17(2)7-13-20)25-21-14-8-18(3)9-15-21;;;;/h2*4-15H,1-3H3;3*1H;/q;;;;;+3/p-3