hexadecyl-dimethyl-(phenylmethyl)azanium; oxidanidyl-(oxidanidyl-bis(oxidanylidene)chromio)oxy-bis(oxidanylidene)chromium

Systemtic Name: hexadecyl-dimethyl-(phenylmethyl)azanium; oxidanidyl-(oxidanidyl-bis(oxidanylidene)chromio)oxy-bis(oxidanylidene)chromium Openeye Name: benzyl-hexadecyl-dimethyl-ammonium; oxido-(oxido(dioxo)chromio)oxy-dioxo-chromium CAS Name: hexadecyl-dimethyl-(phenylmethyl)ammonium; oxido-(oxido(dioxo)chromio)oxy-dioxochromium IUPAC Name: benzyl-hexadecyl-dimethylazanium; oxido-(oxido(dioxo)chromio)oxy-dioxochromium Traditional Name: benzyl-cetyl-dimethyl-ammonium; (diketo(oxido)chromio)oxy-diketo-oxido-chromium Formula: C50H92Cr2N2O7 MolecularWeight: 937.26688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]

InChI

InChI=1S/2C25H46N.2Cr.7O/c2*1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25;;;;;;;;;/h2*17-19,21-22H,4-16,20,23-24H2,1-3H3;;;;;;;;;/q2*+1;;;;;;;;2*-1