N',N'-bis(2-azanylethyl)ethane-1,2-diamine; cobalt(2+); 3-(2,4-dinitronaphthalen-1-yl)pentane-2,4-diol

Systemtic Name: N',N'-bis(2-azanylethyl)ethane-1,2-diamine; cobalt(2+); 3-(2,4-dinitronaphthalen-1-yl)pentane-2,4-diol Openeye Name: cobaltous; N',N'-bis(2-aminoethyl)ethane-1,2-diamine; 3-(2,4-dinitro-1-naphthyl)pentane-2,4-diol CAS Name: N',N'-bis(2-aminoethyl)ethane-1,2-diamine; cobalt(2+); 3-(2,4-dinitro-1-naphthalenyl)pentane-2,4-diol IUPAC Name: N',N'-bis(2-aminoethyl)ethane-1,2-diamine; cobalt(2+); 3-(2,4-dinitronaphthalen-1-yl)pentane-2,4-diol Traditional Name: cobaltous; 3-(2,4-dinitro-1-naphthyl)pentane-2,4-diol; tris(2-aminoethyl)amine Formula: C21H34CoN6O6+2 MolecularWeight: 525.46446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-])C(C)O)O.C(CN(CCN)CCN)N.[Co+2]

Isomeric SMILES

CC(C(C1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-])C(C)O)O.C(CN(CCN)CCN)N.[Co+2]

InChI

InChI=1S/C15H16N2O6.C6H18N4.Co/c1-8(18)14(9(2)19)15-11-6-4-3-5-10(11)12(16(20)21)7-13(15)17(22)23;7-1-4-10(5-2-8)6-3-9;/h3-9,14,18-19H,1-2H3;1-9H2;/q;;+2