[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxylic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxylic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC

InChI

InChI=1S/C20H26N2O6/c1-4-14(5-2)21-17(23)12-28-20(26)13-7-8-15-16(11-13)19(25)22(18(15)24)9-6-10-27-3/h7-8,11,14H,4-6,9-10,12H2,1-3H3,(H,21,23)