2-[11-[4-(4-methoxyphenyl)piperazin-1-yl]-11-oxidanylidene-undecyl]isoindole-1,3-dione

Systemtic Name: 2-[11-[4-(4-methoxyphenyl)piperazin-1-yl]-11-oxidanylidene-undecyl]isoindole-1,3-dione Openeye Name: 2-[11-[4-(4-methoxyphenyl)piperazin-1-yl]-11-oxo-undecyl]isoindoline-1,3-dione CAS Name: 2-[11-[4-(4-methoxyphenyl)-1-piperazinyl]-11-oxoundecyl]isoindole-1,3-dione IUPAC Name: 2-[11-[4-(4-methoxyphenyl)piperazin-1-yl]-11-oxoundecyl]isoindole-1,3-dione Traditional Name: 2-[11-keto-11-[4-(4-methoxyphenyl)piperazino]undecyl]isoindoline-1,3-quinone Formula: C30H39N3O4 MolecularWeight: 505.64836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCCCCCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCCCCCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C30H39N3O4/c1-37-25-17-15-24(16-18-25)31-20-22-32(23-21-31)28(34)14-8-6-4-2-3-5-7-11-19-33-29(35)26-12-9-10-13-27(26)30(33)36/h9-10,12-13,15-18H,2-8,11,14,19-23H2,1H3