3-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 3-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 3-[[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 3-[[4-(2,3,4-trimethoxybenzyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)CN3C4=CC=CC=C4OC3=O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)CN3C4=CC=CC=C4OC3=O)OC)OC

InChI

InChI=1S/C22H27N3O5/c1-27-19-9-8-16(20(28-2)21(19)29-3)14-23-10-12-24(13-11-23)15-25-17-6-4-5-7-18(17)30-22(25)26/h4-9H,10-15H2,1-3H3