buta-1,3-dien-2-ylbenzene; 2-cyclopenta-1,3-dien-1-ylhexan-2-yl-hexan-2-yl-hexan-2-ylimino-oxidanyl-$l^{5}-phosphane; titanium(2+)

Systemtic Name: buta-1,3-dien-2-ylbenzene; 2-cyclopenta-1,3-dien-1-ylhexan-2-yl-hexan-2-yl-hexan-2-ylimino-oxidanyl-$l^{5}-phosphane; titanium(2+) Openeye Name: (1-cyclopenta-1,3-dien-1-yl-1-methyl-pentyl)-hydroxy-(1-methylpentyl)-(1-methylpentylimino)-$l^{5}-phosphane; 1-methyleneallylbenzene; titanium(2+) CAS Name: buta-1,3-dien-2-ylbenzene; 2-(1-cyclopenta-1,3-dienyl)hexan-2-yl-hexan-2-yl-hexan-2-ylimino-hydroxyphosphorane; titanium(2+) IUPAC Name: buta-1,3-dien-2-ylbenzene; 2-cyclopenta-1,3-dien-1-ylhexan-2-yl-hexan-2-yl-hexan-2-ylimino-hydroxy-$l^{5}-phosphane; titanium(2+) Traditional Name: (1-cyclopenta-1,3-dien-1-yl-1-methyl-pentyl)-hydroxy-(1-methylpentyl)-(1-methylpentylimino)phosphorane; 1-methyleneallylbenzene; titanium(2+) Formula: C33H54NOPTi+2 MolecularWeight: 559.628721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)N=P(C(C)CCCC)(C(C)(CCCC)C1=CC=CC1)O.C=CC(=C)C1=CC=CC=C1.[Ti+2]

Isomeric SMILES

CCCCC(C)N=P(C(C)CCCC)(C(C)(CCCC)C1=CC=CC1)O.C=CC(=C)C1=CC=CC=C1.[Ti+2]

InChI

InChI=1S/C23H44NOP.C10H10.Ti/c1-7-10-15-20(4)24-26(25,21(5)16-11-8-2)23(6,19-12-9-3)22-17-13-14-18-22;1-3-9(2)10-7-5-4-6-8-10;/h13-14,17,20-21,25H,7-12,15-16,18-19H2,1-6H3;3-8H,1-2H2;/q;;+2