3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]-1-(4-methylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]-1-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]-1-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 3-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]-1-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-1-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]-1-(4-methylpiperazino)propan-1-one Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)N2CCN(CC2)C)N3N=C4C=CC=CC4=N3)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)N2CCN(CC2)C)N3N=C4C=CC=CC4=N3)O

InChI

InChI=1S/C24H31N5O2/c1-24(2,3)18-15-17(9-10-22(30)28-13-11-27(4)12-14-28)16-21(23(18)31)29-25-19-7-5-6-8-20(19)26-29/h5-8,15-16,31H,9-14H2,1-4H3