3-[[3-(4-ethylpiperazin-1-yl)carbonylphenyl]amino]-2-(3-methoxypropyl)-3H-isoindol-1-one

Systemtic Name: 3-[[3-(4-ethylpiperazin-1-yl)carbonylphenyl]amino]-2-(3-methoxypropyl)-3H-isoindol-1-one Openeye Name: 3-[3-(4-ethylpiperazine-1-carbonyl)anilino]-2-(3-methoxypropyl)isoindolin-1-one CAS Name: 3-[3-[(4-ethyl-1-piperazinyl)-oxomethyl]anilino]-2-(3-methoxypropyl)-3H-isoindol-1-one IUPAC Name: 3-[3-(4-ethylpiperazine-1-carbonyl)anilino]-2-(3-methoxypropyl)-3H-isoindol-1-one Traditional Name: 3-[3-(4-ethylpiperazine-1-carbonyl)anilino]-2-(3-methoxypropyl)isoindolin-1-one Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)NC3C4=CC=CC=C4C(=O)N3CCCOC

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)NC3C4=CC=CC=C4C(=O)N3CCCOC

InChI

InChI=1S/C25H32N4O3/c1-3-27-13-15-28(16-14-27)24(30)19-8-6-9-20(18-19)26-23-21-10-4-5-11-22(21)25(31)29(23)12-7-17-32-2/h4-6,8-11,18,23,26H,3,7,12-17H2,1-2H3