3-[(5-chloranyl-2-oxidanyl-phenyl)methyl]chromen-2-one

Systemtic Name: 3-[(5-chloranyl-2-oxidanyl-phenyl)methyl]chromen-2-one Openeye Name: 3-[(5-chloro-2-hydroxy-phenyl)methyl]chromen-2-one CAS Name: 3-[(5-chloro-2-hydroxyphenyl)methyl]-1-benzopyran-2-one IUPAC Name: 3-[(5-chloro-2-hydroxyphenyl)methyl]chromen-2-one Traditional Name: 3-(5-chloro-2-hydroxy-benzyl)coumarin Formula: C16H11ClO3 MolecularWeight: 286.70974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)CC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)CC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C16H11ClO3/c17-13-5-6-14(18)11(9-13)8-12-7-10-3-1-2-4-15(10)20-16(12)19/h1-7,9,18H,8H2