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

Systemtic Name: [2-(1-methoxy-3-methyl-1-phenyl-butyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid Openeye Name: [2-(1-methoxy-3-methyl-1-phenyl-butyl)-6-[4-(tetrahydropyran-2-yloxymethyl)phenyl]-8-quinolyl]phosphonic acid CAS Name: [2-(1-methoxy-3-methyl-1-phenylbutyl)-6-[4-(2-oxanyloxymethyl)phenyl]-8-quinolinyl]phosphonic acid IUPAC Name: [2-(1-methoxy-3-methyl-1-phenylbutyl)-6-[4-(oxan-2-yloxymethyl)phenyl]quinolin-8-yl]phosphonic acid Traditional Name: [2-(1-methoxy-3-methyl-1-phenyl-butyl)-6-[4-(tetrahydropyran-2-yloxymethyl)phenyl]-8-quinolyl]phosphonic acid Formula: C33H38NO6P MolecularWeight: 575.631681

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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)OC

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)OC

InChI

InChI=1S/C33H38NO6P/c1-23(2)21-33(38-3,28-9-5-4-6-10-28)30-17-16-26-19-27(20-29(32(26)34-30)41(35,36)37)25-14-12-24(13-15-25)22-40-31-11-7-8-18-39-31/h4-6,9-10,12-17,19-20,23,31H,7-8,11,18,21-22H2,1-3H3,(H2,35,36,37)