[2-(3-methyl-1-oxidanyl-1-phenyl-butyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid

Systemtic Name: [2-(3-methyl-1-oxidanyl-1-phenyl-butyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid Openeye Name: [2-(1-hydroxy-3-methyl-1-phenyl-butyl)-6-[4-(tetrahydropyran-2-yloxymethyl)phenyl]-8-quinolyl]phosphonic acid CAS Name: [2-(1-hydroxy-3-methyl-1-phenylbutyl)-6-[4-(2-oxanyloxymethyl)phenyl]-8-quinolinyl]phosphonic acid IUPAC Name: [2-(1-hydroxy-3-methyl-1-phenylbutyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid Traditional Name: [2-(1-hydroxy-3-methyl-1-phenyl-butyl)-6-[4-(tetrahydropyran-2-yloxymethyl)phenyl]-8-quinolyl]phosphonic acid Formula: C32H36NO6P MolecularWeight: 561.605101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)(C2=NC3=C(C=C(C=C3C=C2)C4=CC=C(C=C4)COC5CCCCO5)P(=O)(O)O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)(C2=NC3=C(C=C(C=C3C=C2)C4=CC=C(C=C4)COC5CCCCO5)P(=O)(O)O)O

InChI

InChI=1S/C32H36NO6P/c1-22(2)20-32(34,27-8-4-3-5-9-27)29-16-15-25-18-26(19-28(31(25)33-29)40(35,36)37)24-13-11-23(12-14-24)21-39-30-10-6-7-17-38-30/h3-5,8-9,11-16,18-19,22,30,34H,6-7,10,17,20-21H2,1-2H3,(H2,35,36,37)