2-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-chromen-4-one hydrochloride

Systemtic Name: 2-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-chromen-4-one hydrochloride Openeye Name: 2-phenyl-3-[4-(2-pyridyl)piperazine-1-carbonyl]chromen-4-one hydrochloride CAS Name: 3-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 2-phenyl-3-(4-pyridin-2-ylpiperazine-1-carbonyl)chromen-4-one hydrochloride Traditional Name: 2-phenyl-3-[4-(2-pyridyl)piperazine-1-carbonyl]chromone hydrochloride Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C25H21N3O3.ClH/c29-23-19-10-4-5-11-20(19)31-24(18-8-2-1-3-9-18)22(23)25(30)28-16-14-27(15-17-28)21-12-6-7-13-26-21;/h1-13H,14-17H2;1H