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

Systemtic Name: 5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethoxy]-2-(phenylmethyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-benzyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]-3,4-dihydroisoquinolin-1-one CAS Name: 5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethoxy]-2-(phenylmethyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-benzyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-benzyl-5-[2-keto-2-(4-phenylpiperazino)ethoxy]-3,4-dihydroisocarbostyril Formula: C28H29N3O3 MolecularWeight: 455.54816

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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=C5

Isomeric SMILES

C1CN(C(=O)C2=C1C(=CC=C2)OCC(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c32-27(30-18-16-29(17-19-30)23-10-5-2-6-11-23)21-34-26-13-7-12-25-24(26)14-15-31(28(25)33)20-22-8-3-1-4-9-22/h1-13H,14-21H2