1-[6-chloranyl-3-[4-(diphenylmethyl)piperazin-1-yl]quinolin-5-yl]oxypropan-2-ol

Systemtic Name: 1-[6-chloranyl-3-[4-(diphenylmethyl)piperazin-1-yl]quinolin-5-yl]oxypropan-2-ol Openeye Name: 1-[[3-(4-benzhydrylpiperazin-1-yl)-6-chloro-5-quinolyl]oxy]propan-2-ol CAS Name: 1-[[6-chloro-3-[4-(diphenylmethyl)-1-piperazinyl]-5-quinolinyl]oxy]-2-propanol IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)-6-chloroquinolin-5-yl]oxypropan-2-ol Traditional Name: 1-[[3-(4-benzhydrylpiperazino)-6-chloro-5-quinolyl]oxy]propan-2-ol Formula: C29H30ClN3O2 MolecularWeight: 488.0204

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC2=NC=C(C=C21)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)Cl)O

Isomeric SMILES

CC(COC1=C(C=CC2=NC=C(C=C21)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)Cl)O

InChI

InChI=1S/C29H30ClN3O2/c1-21(34)20-35-29-25-18-24(19-31-27(25)13-12-26(29)30)32-14-16-33(17-15-32)28(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-13,18-19,21,28,34H,14-17,20H2,1H3