2-azanylbenzoate; cerium(4+); 2-ethylhexanoate

Systemtic Name: 2-azanylbenzoate; cerium(4+); 2-ethylhexanoate Openeye Name: 2-aminobenzoate; cerium(4+); 2-ethylhexanoate CAS Name: 2-aminobenzoate; cerium(4+); 2-ethylhexanoate IUPAC Name: 2-aminobenzoate; cerium(4+); 2-ethylhexanoate Traditional Name: anthranilate; cerium(4+); 2-ethylhexanoate Formula: C30H42CeN2O8 MolecularWeight: 698.77908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])N.C1=CC=C(C(=C1)C(=O)[O-])N.[Ce+4]

Isomeric SMILES

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])N.C1=CC=C(C(=C1)C(=O)[O-])N.[Ce+4]

InChI

InChI=1S/2C8H16O2.2C7H7NO2.Ce/c2*1-3-5-6-7(4-2)8(9)10;2*8-6-4-2-1-3-5(6)7(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);2*1-4H,8H2,(H,9,10);/q;;;;+4/p-4