dioxidanium; 4-[(4-aminophenyl)methyl]aniline; cadmium(2+); ethanoic acid

Systemtic Name: dioxidanium; 4-[(4-aminophenyl)methyl]aniline; cadmium(2+); ethanoic acid Openeye Name: dioxonium; acetic acid; 4-[(4-aminophenyl)methyl]aniline; cadmium(2+) CAS Name: dioxonium; acetic acid; 4-[(4-aminophenyl)methyl]aniline; cadmium(2+) IUPAC Name: dioxidanium; acetic acid; 4-[(4-aminophenyl)methyl]aniline; cadmium(2+) Traditional Name: dioxonium; acetic acid; [4-(4-aminobenzyl)phenyl]amine; cadmium(2+) Formula: C30H42CdN4O6+4 MolecularWeight: 667.08868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.[OH3+].[OH3+].[Cd+2]

Isomeric SMILES

CC(=O)O.CC(=O)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.[OH3+].[OH3+].[Cd+2]

InChI

InChI=1S/2C13H14N2.2C2H4O2.Cd.2H2O/c2*14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11;2*1-2(3)4;;;/h2*1-8H,9,14-15H2;2*1H3,(H,3,4);;2*1H2/q;;;;+2;;/p+2