3-(1-adamantylcarbonyl)-7-bromanyl-chromen-2-one

Systemtic Name: 3-(1-adamantylcarbonyl)-7-bromanyl-chromen-2-one Openeye Name: 3-(adamantane-1-carbonyl)-7-bromo-chromen-2-one CAS Name: 3-[1-adamantyl(oxo)methyl]-7-bromo-1-benzopyran-2-one IUPAC Name: 3-(adamantane-1-carbonyl)-7-bromochromen-2-one Traditional Name: 3-(adamantane-1-carbonyl)-7-bromo-coumarin Formula: C20H19BrO3 MolecularWeight: 387.26706

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4=CC5=C(C=C(C=C5)Br)OC4=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4=CC5=C(C=C(C=C5)Br)OC4=O

InChI

InChI=1S/C20H19BrO3/c21-15-2-1-14-6-16(19(23)24-17(14)7-15)18(22)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6-7,11-13H,3-5,8-10H2