2-[2-methoxy-6-(2-phosphonopropan-2-yl)naphthalen-1-yl]propan-2-ylphosphonic acid

Systemtic Name: 2-[2-methoxy-6-(2-phosphonopropan-2-yl)naphthalen-1-yl]propan-2-ylphosphonic acid Openeye Name: [1-[2-methoxy-6-(1-methyl-1-phosphono-ethyl)-1-naphthyl]-1-methyl-ethyl]phosphonic acid CAS Name: 2-[2-methoxy-6-(2-phosphonopropan-2-yl)-1-naphthalenyl]propan-2-ylphosphonic acid IUPAC Name: 2-[2-methoxy-6-(2-phosphonopropan-2-yl)naphthalen-1-yl]propan-2-ylphosphonic acid Traditional Name: [1-[2-methoxy-6-(1-methyl-1-phosphono-ethyl)-1-naphthyl]-1-methyl-ethyl]phosphonic acid Formula: C17H24O7P2 MolecularWeight: 402.315782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC2=C(C=C1)C(=C(C=C2)OC)C(C)(C)P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(C)(C1=CC2=C(C=C1)C(=C(C=C2)OC)C(C)(C)P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C17H24O7P2/c1-16(2,25(18,19)20)12-7-8-13-11(10-12)6-9-14(24-5)15(13)17(3,4)26(21,22)23/h6-10H,1-5H3,(H2,18,19,20)(H2,21,22,23)