1-[3-[4-(9H-xanthen-9-yl)piperazin-1-yl]quinolin-2-yl]oxypropan-2-ol

Systemtic Name: 1-[3-[4-(9H-xanthen-9-yl)piperazin-1-yl]quinolin-2-yl]oxypropan-2-ol Openeye Name: 1-[[3-[4-(9H-xanthen-9-yl)piperazin-1-yl]-2-quinolyl]oxy]propan-2-ol CAS Name: 1-[[3-[4-(9H-xanthen-9-yl)-1-piperazinyl]-2-quinolinyl]oxy]-2-propanol IUPAC Name: 1-[3-[4-(9H-xanthen-9-yl)piperazin-1-yl]quinolin-2-yl]oxypropan-2-ol Traditional Name: 1-[[3-[4-(9H-xanthen-9-yl)piperazino]-2-quinolyl]oxy]propan-2-ol Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=NC2=CC=CC=C2C=C1N3CCN(CC3)C4C5=CC=CC=C5OC6=CC=CC=C46)O

Isomeric SMILES

CC(COC1=NC2=CC=CC=C2C=C1N3CCN(CC3)C4C5=CC=CC=C5OC6=CC=CC=C46)O

InChI

InChI=1S/C29H29N3O3/c1-20(33)19-34-29-25(18-21-8-2-5-11-24(21)30-29)31-14-16-32(17-15-31)28-22-9-3-6-12-26(22)35-27-13-7-4-10-23(27)28/h2-13,18,20,28,33H,14-17,19H2,1H3