3a,7a-dihydro-1H-indol-2-ylmethyl 11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoate

Systemtic Name: 3a,7a-dihydro-1H-indol-2-ylmethyl 11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoate Openeye Name: 3a,7a-dihydro-1H-indol-2-ylmethyl 11-(1,3-dioxoisoindolin-2-yl)undecanoate CAS Name: 11-(1,3-dioxo-2-isoindolyl)undecanoic acid 3a,7a-dihydro-1H-indol-2-ylmethyl ester IUPAC Name: 3a,7a-dihydro-1H-indol-2-ylmethyl 11-(1,3-dioxoisoindol-2-yl)undecanoate Traditional Name: 11-phthalimidoundecanoic acid 3a,7a-dihydro-1H-indol-2-ylmethyl ester Formula: C28H34N2O4 MolecularWeight: 462.58056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCCCCCC(=O)OCC3=CC4C=CC=CC4N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCCCCCC(=O)OCC3=CC4C=CC=CC4N3

InChI

InChI=1S/C28H34N2O4/c31-26(34-20-22-19-21-13-8-11-16-25(21)29-22)17-7-5-3-1-2-4-6-12-18-30-27(32)23-14-9-10-15-24(23)28(30)33/h8-11,13-16,19,21,25,29H,1-7,12,17-18,20H2