3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]propanamide

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]propanamide Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]propanamide CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[2-(4-phenyl-1-piperazinyl)ethyl]propanamide IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]propanamide Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[2-(4-phenylpiperazino)ethyl]propionamide Formula: C23H25BrN4O3 MolecularWeight: 485.3736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H25BrN4O3/c24-17-6-7-19-20(16-17)23(31)28(22(19)30)10-8-21(29)25-9-11-26-12-14-27(15-13-26)18-4-2-1-3-5-18/h1-7,16H,8-15H2,(H,25,29)