aluminum 4-(aminomethyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylate

Systemtic Name: aluminum 4-(aminomethyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylate Openeye Name: aluminum 4-(aminomethyl)tetralin-1-carboxylate CAS Name: aluminum 4-(aminomethyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylate IUPAC Name: aluminum 4-(aminomethyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylate Traditional Name: aluminum 4-(aminomethyl)tetralin-1-carboxylate Formula: C36H42AlN3O6 MolecularWeight: 639.716718

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1CN)C(=O)[O-].C1CC(C2=CC=CC=C2C1CN)C(=O)[O-].C1CC(C2=CC=CC=C2C1CN)C(=O)[O-].[Al+3]

Isomeric SMILES

C1CC(C2=CC=CC=C2C1CN)C(=O)[O-].C1CC(C2=CC=CC=C2C1CN)C(=O)[O-].C1CC(C2=CC=CC=C2C1CN)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C12H15NO2.Al/c3*13-7-8-5-6-11(12(14)15)10-4-2-1-3-9(8)10;/h3*1-4,8,11H,5-7,13H2,(H,14,15);/q;;;+3/p-3