2-[(2-fluorophenyl)methyl]-5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethoxy]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[(2-fluorophenyl)methyl]-5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethoxy]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[(2-fluorophenyl)methyl]-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[(2-fluorophenyl)methyl]-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethoxy]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[(2-fluorophenyl)methyl]-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-(2-fluorobenzyl)-5-[2-keto-2-(4-phenylpiperazino)ethoxy]-3,4-dihydroisocarbostyril Formula: C28H28FN3O3 MolecularWeight: 473.538623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C(=CC=C2)OCC(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5F

Isomeric SMILES

C1CN(C(=O)C2=C1C(=CC=C2)OCC(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5F

InChI

InChI=1S/C28H28FN3O3/c29-25-11-5-4-7-21(25)19-32-14-13-23-24(28(32)34)10-6-12-26(23)35-20-27(33)31-17-15-30(16-18-31)22-8-2-1-3-9-22/h1-12H,13-20H2