2-(4-tert-butylphenyl)-8-methoxy-quinoline-4-carboxylate

Systemtic Name: 2-(4-tert-butylphenyl)-8-methoxy-quinoline-4-carboxylate Openeye Name: 2-(4-tert-butylphenyl)-8-methoxy-quinoline-4-carboxylate CAS Name: 2-(4-tert-butylphenyl)-8-methoxy-4-quinolinecarboxylate IUPAC Name: 2-(4-tert-butylphenyl)-8-methoxyquinoline-4-carboxylate Traditional Name: 2-(4-tert-butylphenyl)-8-methoxy-cinchoninate Formula: C21H20NO3- MolecularWeight: 334.3884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)[O-]

InChI

InChI=1S/C21H21NO3/c1-21(2,3)14-10-8-13(9-11-14)17-12-16(20(23)24)15-6-5-7-18(25-4)19(15)22-17/h5-12H,1-4H3,(H,23,24)/p-1