3-(4-chlorophenyl)-6-ethanoyl-4-methyl-5-oxidanyl-chromen-2-one

Systemtic Name: 3-(4-chlorophenyl)-6-ethanoyl-4-methyl-5-oxidanyl-chromen-2-one Openeye Name: 6-acetyl-3-(4-chlorophenyl)-5-hydroxy-4-methyl-chromen-2-one CAS Name: 6-acetyl-3-(4-chlorophenyl)-5-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 6-acetyl-3-(4-chlorophenyl)-5-hydroxy-4-methylchromen-2-one Traditional Name: 6-acetyl-3-(4-chlorophenyl)-5-hydroxy-4-methyl-coumarin Formula: C18H13ClO4 MolecularWeight: 328.74642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C(=C(C=C2)C(=O)C)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C(=C(C=C2)C(=O)C)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H13ClO4/c1-9-15(11-3-5-12(19)6-4-11)18(22)23-14-8-7-13(10(2)20)17(21)16(9)14/h3-8,21H,1-2H3