[2-(cyclooctylamino)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [2-(cyclooctylamino)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [2-(cyclooctylamino)-2-oxo-ethyl] 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid [2-(cyclooctylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclooctylamino)-2-oxoethyl] 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid [2-(cyclooctylamino)-2-keto-ethyl] ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)COC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCC(CCC1)NC(=O)COC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H26N2O5/c24-18(22-15-8-4-2-1-3-5-9-15)14-28-19(25)12-13-23-20(26)16-10-6-7-11-17(16)21(23)27/h6-7,10-11,15H,1-5,8-9,12-14H2,(H,22,24)