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

Systemtic Name: 2-[4-[4-(5-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(5-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(5-methoxy-1,2-benzoxazol-3-yl)-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(5-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(5-methoxyindoxazen-3-yl)piperazino]butyl]isoindoline-1,3-quinone Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)ON=C2N3CCN(CC3)CCCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

COC1=CC2=C(C=C1)ON=C2N3CCN(CC3)CCCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C24H26N4O4/c1-31-17-8-9-21-20(16-17)22(25-32-21)27-14-12-26(13-15-27)10-4-5-11-28-23(29)18-6-2-3-7-19(18)24(28)30/h2-3,6-9,16H,4-5,10-15H2,1H3