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4-(4-naphthalen-1-ylphenyl)-1-phosphono-butane-1-sulfonic acid

4-(4-naphthalen-1-ylphenyl)-1-phosphono-butane-1-sulfonic acid

Systemtic Name:4-(4-naphthalen-1-ylphenyl)-1-phosphono-butane-1-sulfonic acid
Openeye Name:4-[4-(1-naphthyl)phenyl]-1-phosphono-butane-1-sulfonic acid
CAS Name:4-[4-(1-naphthalenyl)phenyl]-1-phosphono-1-butanesulfonic acid
IUPAC Name:4-(4-naphthalen-1-ylphenyl)-1-phosphonobutane-1-sulfonic acid
Traditional Name:4-[4-(1-naphthyl)phenyl]-1-phosphono-butane-1-sulfonic acid
Formula: C20H21O6PS
MolecularWeight: 420.415901
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=CC=C(C=C3)CCCC(P(=O)(O)O)S(=O)(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=CC=C(C=C3)CCCC(P(=O)(O)O)S(=O)(=O)O


InChI

InChI=1S/C20H21O6PS/c21-27(22,23)20(28(24,25)26)10-3-5-15-11-13-17(14-12-15)19-9-4-7-16-6-1-2-8-18(16)19/h1-2,4,6-9,11-14,20H,3,5,10H2,(H2,21,22,23)(H,24,25,26)


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