[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-chloranylpyridine-3-carboxylate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C17H15ClN2O4 MolecularWeight: 346.765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C17H15ClN2O4/c18-16-12(5-3-8-19-16)17(22)24-10-15(21)20-13-7-9-23-14-6-2-1-4-11(13)14/h1-6,8,13H,7,9-10H2,(H,20,21)