carboxymethyl(methyl)azanium; 5-methylcyclopenta-1,3-diene; titanium

Systemtic Name: carboxymethyl(methyl)azanium; 5-methylcyclopenta-1,3-diene; titanium Openeye Name: carboxymethyl(methyl)ammonium; 5-methylcyclopenta-1,3-diene; titanium CAS Name: carboxymethyl(methyl)ammonium; 5-methylcyclopenta-1,3-diene; titanium IUPAC Name: carboxymethyl(methyl)azanium; 5-methylcyclopenta-1,3-diene; titanium Traditional Name: carboxymethyl(methyl)ammonium; 5-methylcyclopenta-1,3-diene; titanium Formula: C18H30N2O4Ti MolecularWeight: 386.3088

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C=CC=C1.C[C-]1C=CC=C1.C[NH2+]CC(=O)O.C[NH2+]CC(=O)O.[Ti]

Isomeric SMILES

C[C-]1C=CC=C1.C[C-]1C=CC=C1.C[NH2+]CC(=O)O.C[NH2+]CC(=O)O.[Ti]

InChI

InChI=1S/2C6H7.2C3H7NO2.Ti/c2*1-6-4-2-3-5-6;2*1-4-2-3(5)6;/h2*2-5H,1H3;2*4H,2H2,1H3,(H,5,6);/q2*-1;;;/p+2