3-(4-methoxyphenyl)-4-[3-[4-(phenylmethyl)piperazin-1-yl]propoxy]-1,3-oxazinan-2-one

Systemtic Name: 3-(4-methoxyphenyl)-4-[3-[4-(phenylmethyl)piperazin-1-yl]propoxy]-1,3-oxazinan-2-one Openeye Name: 4-[3-(4-benzylpiperazin-1-yl)propoxy]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one CAS Name: 3-(4-methoxyphenyl)-4-[3-[4-(phenylmethyl)-1-piperazinyl]propoxy]-1,3-oxazinan-2-one IUPAC Name: 4-[3-(4-benzylpiperazin-1-yl)propoxy]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one Traditional Name: 4-[3-(4-benzylpiperazino)propoxy]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one Formula: C25H33N3O4 MolecularWeight: 439.54722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(CCOC2=O)OCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(CCOC2=O)OCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4/c1-30-23-10-8-22(9-11-23)28-24(12-19-32-25(28)29)31-18-5-13-26-14-16-27(17-15-26)20-21-6-3-2-4-7-21/h2-4,6-11,24H,5,12-20H2,1H3