2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindole-5-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindole-5-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindoline-5-carboxamide CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-[2-(4-phenyl-1-piperazinyl)ethyl]-5-isoindolecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-[2-(4-phenylpiperazino)ethyl]-2-p-phenetyl-isoindoline-5-carboxamide Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O4/c1-2-37-24-11-9-23(10-12-24)33-28(35)25-13-8-21(20-26(25)29(33)36)27(34)30-14-15-31-16-18-32(19-17-31)22-6-4-3-5-7-22/h3-13,20H,2,14-19H2,1H3,(H,30,34)