6-chloranyl-7-methyl-4-[(4-propanoylphenoxy)methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[(4-propanoylphenoxy)methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[(4-propanoylphenoxy)methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[4-(1-oxopropyl)phenoxy]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[(4-propanoylphenoxy)methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(4-propionylphenoxy)methyl]coumarin Formula: C20H17ClO4 MolecularWeight: 356.79958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

InChI

InChI=1S/C20H17ClO4/c1-3-18(22)13-4-6-15(7-5-13)24-11-14-9-20(23)25-19-8-12(2)17(21)10-16(14)19/h4-10H,3,11H2,1-2H3