2-butyl-5-[4-(4-hydroxyphenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-butyl-5-[4-(4-hydroxyphenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-butyl-5-[4-(4-hydroxyphenyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-butyl-5-[[4-(4-hydroxyphenyl)-1-piperazinyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-butyl-5-[4-(4-hydroxyphenyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-butyl-5-[4-(4-hydroxyphenyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C23H25N3O4 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C23H25N3O4/c1-2-3-10-26-22(29)19-9-4-16(15-20(19)23(26)30)21(28)25-13-11-24(12-14-25)17-5-7-18(27)8-6-17/h4-9,15,27H,2-3,10-14H2,1H3