3-methyl-4-[2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]naphthalen-1-ol

Systemtic Name: 3-methyl-4-[2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]naphthalen-1-ol Openeye Name: 4-[2-hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]-3-methyl-naphthalen-1-ol CAS Name: 4-[2-hydroxy-3-[4-(2-pyrimidinyl)-1-piperazinyl]propoxy]-3-methyl-1-naphthalenol IUPAC Name: 4-[2-hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]-3-methylnaphthalen-1-ol Traditional Name: 4-[2-hydroxy-3-[4-(2-pyrimidyl)piperazino]propoxy]-3-methyl-1-naphthol Formula: C22H26N4O3 MolecularWeight: 394.46684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=C1)O)OCC(CN3CCN(CC3)C4=NC=CC=N4)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=C1)O)OCC(CN3CCN(CC3)C4=NC=CC=N4)O

InChI

InChI=1S/C22H26N4O3/c1-16-13-20(28)18-5-2-3-6-19(18)21(16)29-15-17(27)14-25-9-11-26(12-10-25)22-23-7-4-8-24-22/h2-8,13,17,27-28H,9-12,14-15H2,1H3