6-[bis(prop-2-enyl)amino]-5-chloranyl-pyridine-3-carboxylate

Systemtic Name: 6-[bis(prop-2-enyl)amino]-5-chloranyl-pyridine-3-carboxylate Openeye Name: 5-chloro-6-(diallylamino)pyridine-3-carboxylate CAS Name: 6-[bis(prop-2-enyl)amino]-5-chloro-3-pyridinecarboxylate IUPAC Name: 6-[bis(prop-2-enyl)amino]-5-chloropyridine-3-carboxylate Traditional Name: 5-chloro-6-(diallylamino)nicotinate Formula: C12H12ClN2O2- MolecularWeight: 251.68888

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C1=C(C=C(C=N1)C(=O)[O-])Cl

Isomeric SMILES

C=CCN(CC=C)C1=C(C=C(C=N1)C(=O)[O-])Cl

InChI

InChI=1S/C12H13ClN2O2/c1-3-5-15(6-4-2)11-10(13)7-9(8-14-11)12(16)17/h3-4,7-8H,1-2,5-6H2,(H,16,17)/p-1