2,2-dimethylpropane; ethanamine; ethane; ethylazanide; oxidanylidenetitanium; prop-1-ene; dihydroxide; hydrate

Systemtic Name: 2,2-dimethylpropane; ethanamine; ethane; ethylazanide; oxidanylidenetitanium; prop-1-ene; dihydroxide; hydrate Openeye Name: ethanamine; ethane; ethylazanide; neopentane; oxotitanium; prop-1-ene; dihydroxide; hydrate CAS Name: 2,2-dimethylpropane; ethanamine; ethane; ethylazanide; oxotitanium; 1-propene; dihydroxide; hydrate IUPAC Name: 2,2-dimethylpropane; ethanamine; ethane; ethylazanide; oxotitanium; prop-1-ene; dihydroxide; hydrate Traditional Name: ethane; ethylamine; ethylazanide; ketotitanium; neopentane; prop-1-ene; dihydroxide; hydrate Formula: C19H50N3O4Ti-7 MolecularWeight: 432.485

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Descriptors Computed from Structure

Canonical SMILES:

C[CH2-].CCN.CC=C.CC=C.CC(C)(C)C.[CH2-]C[NH-].[CH2-]C[NH-].O.[OH-].[OH-].O=[Ti]

Isomeric SMILES

C[CH2-].CCN.CC=C.CC=C.CC(C)(C)C.[CH2-]C[NH-].[CH2-]C[NH-].O.[OH-].[OH-].O=[Ti]

InChI

InChI=1S/C5H12.2C3H6.C2H7N.2C2H5N.C2H5.3H2O.O.Ti/c1-5(2,3)4;2*1-3-2;3*1-2-3;1-2;;;;;/h1-4H3;2*3H,1H2,2H3;2-3H2,1H3;2*3H,1-2H2;1H2,2H3;3*1H2;;/q;;;;2*-2;-1;;;;;/p-2