6-[(4-tert-butylphenyl)amino]-5-chloranyl-pyridine-3-carboxylate

Systemtic Name: 6-[(4-tert-butylphenyl)amino]-5-chloranyl-pyridine-3-carboxylate Openeye Name: 6-(4-tert-butylanilino)-5-chloro-pyridine-3-carboxylate CAS Name: 6-(4-tert-butylanilino)-5-chloro-3-pyridinecarboxylate IUPAC Name: 6-(4-tert-butylanilino)-5-chloropyridine-3-carboxylate Traditional Name: 6-(4-tert-butylanilino)-5-chloro-nicotinate Formula: C16H16ClN2O2- MolecularWeight: 303.76344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=C(C=C(C=N2)C(=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=C(C=C(C=N2)C(=O)[O-])Cl

InChI

InChI=1S/C16H17ClN2O2/c1-16(2,3)11-4-6-12(7-5-11)19-14-13(17)8-10(9-18-14)15(20)21/h4-9H,1-3H3,(H,18,19)(H,20,21)/p-1