2-[(6-butoxypyridin-3-yl)amino]-4-chloranyl-benzoate

Systemtic Name: 2-[(6-butoxypyridin-3-yl)amino]-4-chloranyl-benzoate Openeye Name: 2-[(6-butoxy-3-pyridyl)amino]-4-chloro-benzoate CAS Name: 2-[(6-butoxy-3-pyridinyl)amino]-4-chlorobenzoate IUPAC Name: 2-[(6-butoxypyridin-3-yl)amino]-4-chlorobenzoate Traditional Name: 2-[(6-butoxy-3-pyridyl)amino]-4-chloro-benzoate Formula: C16H16ClN2O3- MolecularWeight: 319.76284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC=C(C=C1)NC2=C(C=CC(=C2)Cl)C(=O)[O-]

Isomeric SMILES

CCCCOC1=NC=C(C=C1)NC2=C(C=CC(=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C16H17ClN2O3/c1-2-3-8-22-15-7-5-12(10-18-15)19-14-9-11(17)4-6-13(14)16(20)21/h4-7,9-10,19H,2-3,8H2,1H3,(H,20,21)/p-1