2-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-3,4-dihydroisoquinolin-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCCN3CCC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCCN3CCC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H33N3O2/c1-30-24-12-6-5-11-23(24)27-19-17-26(18-20-27)14-7-2-8-15-28-16-13-21-9-3-4-10-22(21)25(28)29/h3-6,9-12H,2,7-8,13-20H2,1H3