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

Systemtic Name: 2-(3-ethoxypropyl)-3-[[3-(4-ethylpiperazin-1-yl)carbonylphenyl]amino]-3H-isoindol-1-one Openeye Name: 2-(3-ethoxypropyl)-3-[3-(4-ethylpiperazine-1-carbonyl)anilino]isoindolin-1-one CAS Name: 2-(3-ethoxypropyl)-3-[3-[(4-ethyl-1-piperazinyl)-oxomethyl]anilino]-3H-isoindol-1-one IUPAC Name: 2-(3-ethoxypropyl)-3-[3-(4-ethylpiperazine-1-carbonyl)anilino]-3H-isoindol-1-one Traditional Name: 2-(3-ethoxypropyl)-3-[3-(4-ethylpiperazine-1-carbonyl)anilino]isoindolin-1-one Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)NC3C4=CC=CC=C4C(=O)N3CCCOCC

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)NC3C4=CC=CC=C4C(=O)N3CCCOCC

InChI

InChI=1S/C26H34N4O3/c1-3-28-14-16-29(17-15-28)25(31)20-9-7-10-21(19-20)27-24-22-11-5-6-12-23(22)26(32)30(24)13-8-18-33-4-2/h5-7,9-12,19,24,27H,3-4,8,13-18H2,1-2H3