[2-[(6-chloranyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate

Systemtic Name: [2-[(6-chloranyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate Openeye Name: [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl] 6-methylpyridine-3-carboxylate CAS Name: 6-methyl-3-pyridinecarboxylic acid [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 6-methylpyridine-3-carboxylate Traditional Name: 6-methylnicotinic acid [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl] ester Formula: C16H13ClN2O5 MolecularWeight: 348.73782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)OCC(=O)NC2=CC3=C(C=C2Cl)OCO3

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)OCC(=O)NC2=CC3=C(C=C2Cl)OCO3

InChI

InChI=1S/C16H13ClN2O5/c1-9-2-3-10(6-18-9)16(21)22-7-15(20)19-12-5-14-13(4-11(12)17)23-8-24-14/h2-6H,7-8H2,1H3,(H,19,20)