azane; azanide; benzene; 2-methanidyl-2-methyl-propane; prop-1-ene; titanium(2+); hydrate

Systemtic Name: azane; azanide; benzene; 2-methanidyl-2-methyl-propane; prop-1-ene; titanium(2+); hydrate Openeye Name: ammonia; azanide; benzene; 2-methanidyl-2-methyl-propane; prop-1-ene; titanium(2+); hydrate CAS Name: ammonia; azanide; benzene; 2-methanidyl-2-methylpropane; 1-propene; titanium(2+); hydrate IUPAC Name: azane; azanide; benzene; 2-methanidyl-2-methylpropane; prop-1-ene; titanium(2+); hydrate Traditional Name: ammonia; azanide; benzene; 2-methanidyl-2-methyl-propane; prop-1-ene; titanium(2+); hydrate Formula: C17H35N3OTi-4 MolecularWeight: 345.3463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[CH2-].[CH2-]C=C.[CH2-]C=C.C1=CC=[C-]C=C1.N.[NH2-].[NH2-].O.[Ti+2]

Isomeric SMILES

CC(C)(C)[CH2-].[CH2-]C=C.[CH2-]C=C.C1=CC=[C-]C=C1.N.[NH2-].[NH2-].O.[Ti+2]

InChI

InChI=1S/C6H5.C5H11.2C3H5.H3N.2H2N.H2O.Ti/c1-2-4-6-5-3-1;1-5(2,3)4;2*1-3-2;;;;;/h1-5H;1H2,2-4H3;2*3H,1-2H2;1H3;3*1H2;/q4*-1;;2*-1;;+2