5-methyl-2-[4-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 5-methyl-2-[4-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 5-methyl-2-[4-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 5-methyl-2-[4-[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 5-methyl-2-[4-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-keto-4-[4-[(3-methylisoxazol-5-yl)methyl]piperazino]butyl]-5-methyl-isoindoline-1,3-quinone Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)N3CCN(CC3)CC4=CC(=NO4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)N3CCN(CC3)CC4=CC(=NO4)C

InChI

InChI=1S/C22H26N4O4/c1-15-5-6-18-19(12-15)22(29)26(21(18)28)7-3-4-20(27)25-10-8-24(9-11-25)14-17-13-16(2)23-30-17/h5-6,12-13H,3-4,7-11,14H2,1-2H3