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

Systemtic Name: buta-1,3-dien-2-ylbenzene; 2-cyclopenta-1,3-dien-1-ylpentan-2-yl-oxidanyl-pentan-2-yl-pentan-2-ylimino-$l^{5}-phosphane; titanium(2+) Openeye Name: (1-cyclopenta-1,3-dien-1-yl-1-methyl-butyl)-hydroxy-(1-methylbutyl)-(1-methylbutylimino)-$l^{5}-phosphane; 1-methyleneallylbenzene; titanium(2+) CAS Name: buta-1,3-dien-2-ylbenzene; 2-(1-cyclopenta-1,3-dienyl)pentan-2-yl-hydroxy-pentan-2-yl-pentan-2-yliminophosphorane; titanium(2+) IUPAC Name: buta-1,3-dien-2-ylbenzene; 2-cyclopenta-1,3-dien-1-ylpentan-2-yl-hydroxy-pentan-2-yl-pentan-2-ylimino-$l^{5}-phosphane; titanium(2+) Traditional Name: (1-cyclopenta-1,3-dien-1-yl-1-methyl-butyl)-hydroxy-(1-methylbutyl)-(1-methylbutylimino)phosphorane; 1-methyleneallylbenzene; titanium(2+) Formula: C30H48NOPTi+2 MolecularWeight: 517.548981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H38NOP.C10H10.Ti/c1-7-12-17(4)21-23(22,18(5)13-8-2)20(6,16-9-3)19-14-10-11-15-19;1-3-9(2)10-7-5-4-6-8-10;/h10-11,14,17-18,22H,7-9,12-13,15-16H2,1-6H3;3-8H,1-2H2;/q;;+2