methyl 1-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[2-(3-methoxypropyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3(CCCCC3)C(=O)OC

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3(CCCCC3)C(=O)OC

InChI

InChI=1S/C21H26N2O6/c1-28-12-6-11-23-18(25)15-8-7-14(13-16(15)19(23)26)17(24)22-21(20(27)29-2)9-4-3-5-10-21/h7-8,13H,3-6,9-12H2,1-2H3,(H,22,24)