6-bromanyl-3-(2-phenoxyethoxy)-2-[4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]chromen-4-one

Systemtic Name: 6-bromanyl-3-(2-phenoxyethoxy)-2-[4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]chromen-4-one Openeye Name: 6-bromo-3-(2-phenoxyethoxy)-2-[4-[4-(2-pyridyl)piperazin-1-yl]phenyl]chromen-4-one CAS Name: 6-bromo-3-(2-phenoxyethoxy)-2-[4-[4-(2-pyridinyl)-1-piperazinyl]phenyl]-1-benzopyran-4-one IUPAC Name: 6-bromo-3-(2-phenoxyethoxy)-2-[4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]chromen-4-one Traditional Name: 6-bromo-3-(2-phenoxyethoxy)-2-[4-[4-(2-pyridyl)piperazino]phenyl]chromone Formula: C32H28BrN3O4 MolecularWeight: 598.48642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C3=C(C(=O)C4=C(O3)C=CC(=C4)Br)OCCOC5=CC=CC=C5)C6=CC=CC=N6

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C3=C(C(=O)C4=C(O3)C=CC(=C4)Br)OCCOC5=CC=CC=C5)C6=CC=CC=N6

InChI

InChI=1S/C32H28BrN3O4/c33-24-11-14-28-27(22-24)30(37)32(39-21-20-38-26-6-2-1-3-7-26)31(40-28)23-9-12-25(13-10-23)35-16-18-36(19-17-35)29-8-4-5-15-34-29/h1-15,22H,16-21H2