ethyl 4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]piperidin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]piperidin-1-yl]benzoate Openeye Name: ethyl 4-[4-(1,3-dioxoisoindolin-2-yl)-1-piperidyl]benzoate CAS Name: 4-[4-(1,3-dioxo-2-isoindolyl)-1-piperidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(1,3-dioxoisoindol-2-yl)piperidin-1-yl]benzoate Traditional Name: 4-(4-phthalimidopiperidino)benzoic acid ethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CCC(CC2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CCC(CC2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N2O4/c1-2-28-22(27)15-7-9-16(10-8-15)23-13-11-17(12-14-23)24-20(25)18-5-3-4-6-19(18)21(24)26/h3-10,17H,2,11-14H2,1H3