ethyl 4-chloranyl-3-methyl-5-(3-oxidanylpropyliminomethyl)-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 4-chloranyl-3-methyl-5-(3-oxidanylpropyliminomethyl)-1-benzofuran-2-carboxylate Openeye Name: ethyl 4-chloro-5-(3-hydroxypropyliminomethyl)-3-methyl-benzofuran-2-carboxylate CAS Name: 4-chloro-5-(3-hydroxypropyliminomethyl)-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-5-(3-hydroxypropyliminomethyl)-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 4-chloro-5-(3-hydroxypropyliminomethyl)-3-methyl-coumarilic acid ethyl ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C=NCCCO)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C=NCCCO)C

InChI

InChI=1S/C16H18ClNO4/c1-3-21-16(20)15-10(2)13-12(22-15)6-5-11(14(13)17)9-18-7-4-8-19/h5-6,9,19H,3-4,7-8H2,1-2H3