methyl 1-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-oxopyridine-3-carboxylate Traditional Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-keto-nicotinic acid methyl ester Formula: C16H14ClNO5 MolecularWeight: 335.73906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C16H14ClNO5/c1-21-16(20)11-2-3-14(19)18(9-11)8-10-6-12(17)15-13(7-10)22-4-5-23-15/h2-3,6-7,9H,4-5,8H2,1H3