Benzoic acid, 2-[(1-oxo-9-octadecenyl)amino]-, chromium complex

CAS Name

Chromium, tris[2-[(1-oxo-9-octadecenyl)amino]benzoato-O¹,O²]-

Molecular Formula

C₇₅H₁₁₄CrN₃O₉

Other Names and Identifiers

InChI

InChI=1S/3C25H39NO3.Cr/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24(27)26-23-20-18-17-19-22(23)25(28)29;/h3*9-10,17-20H,2-8,11-16,21H2,1H3,(H,26,27)(H,28,29);/q;;;+3/p-3

InChIKey

InChIKey=RWMYOTCGPCXWKC-UHFFFAOYSA-K

SMILES

C(CCCCCCC=CCCCCCCCC)C1=O[Cr+3]23(O=C(CCCCCCCC=CCCCCCCCC)NC=4C(C(=O)[O-]2)=CC=CC4)(O=C(CCCCCCCC=CCCCCCCCC)NC=5C(C(=O)[O-]3)=CC=CC5)[O-]C(=O)C=6C(N1)=CC=CC6

Canonical SMILES

O=C1[O-][Cr+3]23(O=C(NC=4C=CC=CC14)CCCCCCCC=CCCCCCCCC)(O=C(NC=5C=CC=CC5C(=O)[O-]2)CCCCCCCC=CCCCCCCCC)O=C(NC=6C=CC=CC6C(=O)[O-]3)CCCCCCCC=CCCCCCCCC

Other Names for this Substance