[4-[[8-(phosphonomethyl)naphthalen-1-yl]methoxymethyl]phenyl]phosphonic acid

Systemtic Name: [4-[[8-(phosphonomethyl)naphthalen-1-yl]methoxymethyl]phenyl]phosphonic acid Openeye Name: [4-[[8-(phosphonomethyl)-1-naphthyl]methoxymethyl]phenyl]phosphonic acid CAS Name: [4-[[8-(phosphonomethyl)-1-naphthalenyl]methoxymethyl]phenyl]phosphonic acid IUPAC Name: [4-[[8-(phosphonomethyl)naphthalen-1-yl]methoxymethyl]phenyl]phosphonic acid Traditional Name: [8-[(4-phosphonobenzyl)oxymethyl]-1-naphthyl]methylphosphonic acid Formula: C19H20O7P2 MolecularWeight: 422.305422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)COCC3=CC=C(C=C3)P(=O)(O)O)C(=CC=C2)CP(=O)(O)O

Isomeric SMILES

C1=CC2=C(C(=C1)COCC3=CC=C(C=C3)P(=O)(O)O)C(=CC=C2)CP(=O)(O)O

InChI

InChI=1S/C19H20O7P2/c20-27(21,22)13-17-6-2-4-15-3-1-5-16(19(15)17)12-26-11-14-7-9-18(10-8-14)28(23,24)25/h1-10H,11-13H2,(H2,20,21,22)(H2,23,24,25)