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

Systemtic Name: 3-[(3-bromanyl-5-chloranyl-2-oxidanyl-phenyl)methyl]chromen-2-one Openeye Name: 3-[(3-bromo-5-chloro-2-hydroxy-phenyl)methyl]chromen-2-one CAS Name: 3-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl]-1-benzopyran-2-one IUPAC Name: 3-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl]chromen-2-one Traditional Name: 3-(3-bromo-5-chloro-2-hydroxy-benzyl)coumarin Formula: C16H10BrClO3 MolecularWeight: 365.6058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)CC3=CC(=CC(=C3O)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)CC3=CC(=CC(=C3O)Br)Cl

InChI

InChI=1S/C16H10BrClO3/c17-13-8-12(18)7-10(15(13)19)6-11-5-9-3-1-2-4-14(9)21-16(11)20/h1-5,7-8,19H,6H2