1-[4-[3-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[3-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[3-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-hydroxy-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[3-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-hydroxypropoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[3-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-hydroxypropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[3-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-hydroxy-propoxy]phenyl]propan-1-one Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN3C(C2)CCC4=CC=CC=C43)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN3C(C2)CCC4=CC=CC=C43)O

InChI

InChI=1S/C24H30N2O3/c1-2-24(28)19-8-11-22(12-9-19)29-17-21(27)16-25-13-14-26-20(15-25)10-7-18-5-3-4-6-23(18)26/h3-6,8-9,11-12,20-21,27H,2,7,10,13-17H2,1H3