zinc; azanide; 1,3-dicyclohexylpropane-1,3-diol; 4-methylpiperidin-1-ide; dihydrate

Systemtic Name: zinc; azanide; 1,3-dicyclohexylpropane-1,3-diol; 4-methylpiperidin-1-ide; dihydrate Openeye Name: zinc; azanide; 1,3-dicyclohexylpropane-1,3-diol; 4-methylpiperidin-1-ide; dihydrate CAS Name: zinc; azanide; 1,3-dicyclohexylpropane-1,3-diol; 4-methylpiperidin-1-ide; dihydrate IUPAC Name: zinc; azanide; 1,3-dicyclohexylpropane-1,3-diol; 4-methylpiperidin-1-ide; dihydrate Traditional Name: zinc; azanide; 1,3-dicyclohexylpropane-1,3-diol; 4-methylpiperidin-1-ide; dihydrate Formula: C21H46N2O4Zn MolecularWeight: 456.00994

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N-]CC1.C1CCC(CC1)C(CC(C2CCCCC2)O)O.[NH2-].O.O.[Zn+2]

Isomeric SMILES

CC1CC[N-]CC1.C1CCC(CC1)C(CC(C2CCCCC2)O)O.[NH2-].O.O.[Zn+2]

InChI

InChI=1S/C15H28O2.C6H12N.H2N.2H2O.Zn/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;1-6-2-4-7-5-3-6;;;;/h12-17H,1-11H2;6H,2-5H2,1H3;3*1H2;/q;2*-1;;;+2