4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-8-(pyrrolidin-1-ylmethyl)chromen-2-one

Systemtic Name: 4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-8-(pyrrolidin-1-ylmethyl)chromen-2-one Openeye Name: 4-(6-bromo-2-oxo-chromen-3-yl)-7-hydroxy-8-(pyrrolidin-1-ylmethyl)chromen-2-one CAS Name: 4-(6-bromo-2-oxo-1-benzopyran-3-yl)-7-hydroxy-8-(1-pyrrolidinylmethyl)-1-benzopyran-2-one IUPAC Name: 4-(6-bromo-2-oxochromen-3-yl)-7-hydroxy-8-(pyrrolidin-1-ylmethyl)chromen-2-one Traditional Name: 4-(6-bromo-2-keto-chromen-3-yl)-7-hydroxy-8-(pyrrolidinomethyl)coumarin Formula: C23H18BrNO5 MolecularWeight: 468.29672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C=CC(=C5)Br)OC4=O)O

Isomeric SMILES

C1CCN(C1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C=CC(=C5)Br)OC4=O)O

InChI

InChI=1S/C23H18BrNO5/c24-14-3-6-20-13(9-14)10-17(23(28)29-20)16-11-21(27)30-22-15(16)4-5-19(26)18(22)12-25-7-1-2-8-25/h3-6,9-11,26H,1-2,7-8,12H2