3-[(3-chloranyl-4-oxidanyl-phenyl)methyl]chromen-2-one

Systemtic Name: 3-[(3-chloranyl-4-oxidanyl-phenyl)methyl]chromen-2-one Openeye Name: 3-[(3-chloro-4-hydroxy-phenyl)methyl]chromen-2-one CAS Name: 3-[(3-chloro-4-hydroxyphenyl)methyl]-1-benzopyran-2-one IUPAC Name: 3-[(3-chloro-4-hydroxyphenyl)methyl]chromen-2-one Traditional Name: 3-(3-chloro-4-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=CC(=C(C=C3)O)Cl

Isomeric SMILES

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

InChI

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