2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-3,4,5,6-tetrahydro-2-benzazocin-1-one

Systemtic Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-3,4,5,6-tetrahydro-2-benzazocin-1-one Openeye Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-3,4,5,6-tetrahydro-2-benzazocin-1-one CAS Name: 2-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-3,4,5,6-tetrahydro-2-benzazocin-1-one IUPAC Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-3,4,5,6-tetrahydro-2-benzazocin-1-one Traditional Name: 2-[3-[4-(4-methoxyphenyl)piperazino]propyl]-3,4,5,6-tetrahydro-2-benzazocin-1-one Formula: C25H33N3O2 MolecularWeight: 407.54842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCN3CCCCC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCN3CCCCC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H33N3O2/c1-30-23-12-10-22(11-13-23)27-19-17-26(18-20-27)14-6-16-28-15-5-4-8-21-7-2-3-9-24(21)25(28)29/h2-3,7,9-13H,4-6,8,14-20H2,1H3