[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-(1,3-dioxoisoindolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-2-isoindolyl)acetic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-phthalimidoacetic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H21N3O6 MolecularWeight: 375.37584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)CN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)CN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C18H21N3O6/c1-11(2)7-8-19-18(26)20-14(22)10-27-15(23)9-21-16(24)12-5-3-4-6-13(12)17(21)25/h3-6,11H,7-10H2,1-2H3,(H2,19,20,22,26)