[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 5-chloranyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 5-chloranyl-1-benzofuran-2-carboxylate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 5-chlorobenzofuran-2-carboxylate CAS Name: 5-chloro-2-benzofurancarboxylic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 5-chloro-1-benzofuran-2-carboxylate Traditional Name: 5-chlorocoumarilic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC2=C(O1)C=CC(=C2)Cl

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=CC2=C(O1)C=CC(=C2)Cl

InChI

InChI=1S/C16H18ClNO4/c1-3-4-10(2)18-15(19)9-21-16(20)14-8-11-7-12(17)5-6-13(11)22-14/h5-8,10H,3-4,9H2,1-2H3,(H,18,19)/t10-/m0/s1