1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-methyl-pyrrol-2-yl]methyl]azocan-2-one

Systemtic Name: 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-methyl-pyrrol-2-yl]methyl]azocan-2-one Openeye Name: 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-methyl-pyrrol-2-yl]methyl]azocan-2-one CAS Name: 1-[[5-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-1-methyl-2-pyrrolyl]methyl]-2-azocanone IUPAC Name: 1-[[5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-methylpyrrol-2-yl]methyl]azocan-2-one Traditional Name: 1-[[5-[[4-(2-methoxyphenyl)piperazino]methyl]-1-methyl-pyrrol-2-yl]methyl]azocan-2-one Formula: C25H36N4O2 MolecularWeight: 424.57894

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1CN2CCCCCCC2=O)CN3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CN1C(=CC=C1CN2CCCCCCC2=O)CN3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H36N4O2/c1-26-21(12-13-22(26)20-29-14-8-4-3-5-11-25(29)30)19-27-15-17-28(18-16-27)23-9-6-7-10-24(23)31-2/h6-7,9-10,12-13H,3-5,8,11,14-20H2,1-2H3