tert-butyl-tert-butylimino-(1-cyclopenta-1,3-dien-1-yl-2-methyl-propan-2-yl)-oxidanidyl-$l^{5}-phosphane; titanium(4+)

Systemtic Name: tert-butyl-tert-butylimino-(1-cyclopenta-1,3-dien-1-yl-2-methyl-propan-2-yl)-oxidanidyl-$l^{5}-phosphane; titanium(4+) Openeye Name: tert-butyl-tert-butylimino-(2-cyclopenta-1,3-dien-1-yl-1,1-dimethyl-ethyl)-oxido-$l^{5}-phosphane; titanium(4+) CAS Name: tert-butyl-tert-butylimino-[1-(1-cyclopenta-1,3-dienyl)-2-methylpropan-2-yl]-oxidophosphorane; titanium(4+) IUPAC Name: tert-butyl-tert-butylimino-(1-cyclopenta-1,3-dien-1-yl-2-methylpropan-2-yl)-oxido-$l^{5}-phosphane; titanium(4+) Traditional Name: tert-butyl-tert-butylimino-(2-cyclopenta-1,3-dien-1-yl-1,1-dimethyl-ethyl)-oxido-phosphorane; titanium(4+) Formula: C68H124N4O4P4Ti MolecularWeight: 1233.498604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].[Ti+4]

Isomeric SMILES

CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].CC(C)(C)N=P(C(C)(C)C)(C(C)(C)CC1=CC=CC1)[O-].[Ti+4]

InChI

InChI=1S/4C17H31NOP.Ti/c4*1-15(2,3)18-20(19,16(4,5)6)17(7,8)13-14-11-9-10-12-14;/h4*9-11H,12-13H2,1-8H3;/q4*-1;+4