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

Systemtic Name: 5-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-2-butyl-isoindole-1,3-dione Openeye Name: 5-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-2-butyl-isoindoline-1,3-dione CAS Name: 5-[[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-oxomethyl]-2-butylisoindole-1,3-dione IUPAC Name: 5-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-2-butylisoindole-1,3-dione Traditional Name: 5-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-2-butyl-isoindoline-1,3-quinone Formula: C25H25N3O4 MolecularWeight: 431.4837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H25N3O4/c1-2-3-12-28-24(30)18-9-8-17(15-19(18)25(28)31)23(29)27-13-10-16(11-14-27)22-26-20-6-4-5-7-21(20)32-22/h4-9,15-16H,2-3,10-14H2,1H3