ethyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(4-phenylpiperazin-1-yl)butanoate

Systemtic Name: ethyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(4-phenylpiperazin-1-yl)butanoate Openeye Name: ethyl 4-(1,3-dioxoisoindolin-2-yl)-2-(4-phenylpiperazin-1-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)-2-(4-phenyl-1-piperazinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(1,3-dioxoisoindol-2-yl)-2-(4-phenylpiperazin-1-yl)butanoate Traditional Name: 2-(4-phenylpiperazino)-4-phthalimido-butyric acid ethyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN1C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(CCN1C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4/c1-2-31-24(30)21(26-16-14-25(15-17-26)18-8-4-3-5-9-18)12-13-27-22(28)19-10-6-7-11-20(19)23(27)29/h3-11,21H,2,12-17H2,1H3