2-[[4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazino]methyl]-1H-quinazolin-4-one Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(CN2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3)O

InChI

InChI=1S/C24H30N4O3/c1-17-7-8-18(2)22(13-17)31-16-19(29)14-27-9-11-28(12-10-27)15-23-25-21-6-4-3-5-20(21)24(30)26-23/h3-8,13,19,29H,9-12,14-16H2,1-2H3,(H,25,26,30)