1-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[4-(2-methoxyphenyl)-1-piperazinyl]pentane-1,5-dione IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[4-(2-methoxyphenyl)piperazino]pentane-1,5-dione Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H31N3O3/c1-31-23-10-5-4-9-22(23)26-15-17-27(18-16-26)24(29)11-6-12-25(30)28-14-13-20-7-2-3-8-21(20)19-28/h2-5,7-10H,6,11-19H2,1H3