3-[3-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]propoxy]-1H-quinolin-2-one

Systemtic Name: 3-[3-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]propoxy]-1H-quinolin-2-one Openeye Name: 3-[3-[4-[phenyl(2-pyridyl)methyl]piperazin-1-yl]propoxy]-1H-quinolin-2-one CAS Name: 3-[3-[4-[phenyl(2-pyridinyl)methyl]-1-piperazinyl]propoxy]-1H-quinolin-2-one IUPAC Name: 3-[3-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]propoxy]-1H-quinolin-2-one Traditional Name: 3-[3-[4-[phenyl(2-pyridyl)methyl]piperazino]propoxy]carbostyril Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC3=CC=CC=C3NC2=O)C(C4=CC=CC=C4)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1CCCOC2=CC3=CC=CC=C3NC2=O)C(C4=CC=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C28H30N4O2/c33-28-26(21-23-11-4-5-12-24(23)30-28)34-20-8-15-31-16-18-32(19-17-31)27(22-9-2-1-3-10-22)25-13-6-7-14-29-25/h1-7,9-14,21,27H,8,15-20H2,(H,30,33)