7-bromanyl-2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]carbonyl-chromen-4-one

Systemtic Name: 7-bromanyl-2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]carbonyl-chromen-4-one Openeye Name: 7-bromo-2-[4-[2-(4-pyridyl)ethyl]piperazine-1-carbonyl]chromen-4-one CAS Name: 7-bromo-2-[oxo-[4-(2-pyridin-4-ylethyl)-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 7-bromo-2-[4-(2-pyridin-4-ylethyl)piperazine-1-carbonyl]chromen-4-one Traditional Name: 7-bromo-2-[4-[2-(4-pyridyl)ethyl]piperazine-1-carbonyl]chromone Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=NC=C2)C(=O)C3=CC(=O)C4=C(O3)C=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CCC2=CC=NC=C2)C(=O)C3=CC(=O)C4=C(O3)C=C(C=C4)Br

InChI

InChI=1S/C21H20BrN3O3/c22-16-1-2-17-18(26)14-20(28-19(17)13-16)21(27)25-11-9-24(10-12-25)8-5-15-3-6-23-7-4-15/h1-4,6-7,13-14H,5,8-12H2