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

Systemtic Name: [2-(1-methoxy-1-phenyl-butyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid Openeye Name: [2-(1-methoxy-1-phenyl-butyl)-6-[4-(tetrahydropyran-2-yloxymethyl)phenyl]-8-quinolyl]phosphonic acid CAS Name: [2-(1-methoxy-1-phenylbutyl)-6-[4-(2-oxanyloxymethyl)phenyl]-8-quinolinyl]phosphonic acid IUPAC Name: [2-(1-methoxy-1-phenylbutyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid Traditional Name: [2-(1-methoxy-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H36NO6P/c1-3-18-32(37-2,27-9-5-4-6-10-27)29-17-16-25-20-26(21-28(31(25)33-29)40(34,35)36)24-14-12-23(13-15-24)22-39-30-11-7-8-19-38-30/h4-6,9-10,12-17,20-21,30H,3,7-8,11,18-19,22H2,1-2H3,(H2,34,35,36)