[3-chloranyl-2-oxidanylidene-4-(phenoxymethyl)chromen-7-yl] 2-acetamidopropanoate

Systemtic Name: [3-chloranyl-2-oxidanylidene-4-(phenoxymethyl)chromen-7-yl] 2-acetamidopropanoate Openeye Name: [3-chloro-2-oxo-4-(phenoxymethyl)chromen-7-yl] 2-acetamidopropanoate CAS Name: 2-acetamidopropanoic acid [3-chloro-2-oxo-4-(phenoxymethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-chloro-2-oxo-4-(phenoxymethyl)chromen-7-yl] 2-acetamidopropanoate Traditional Name: 2-acetamidopropionic acid [3-chloro-2-keto-4-(phenoxymethyl)chromen-7-yl] ester Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)COC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)COC3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C21H18ClNO6/c1-12(23-13(2)24)20(25)28-15-8-9-16-17(11-27-14-6-4-3-5-7-14)19(22)21(26)29-18(16)10-15/h3-10,12H,11H2,1-2H3,(H,23,24)