calcium naphthalen-1-yl phosphate hydrate

Systemtic Name: calcium naphthalen-1-yl phosphate hydrate Openeye Name: calcium 1-naphthyl phosphate hydrate CAS Name: calcium 1-naphthalenyl phosphate hydrate IUPAC Name: calcium naphthalen-1-yl phosphate hydrate Traditional Name: calcium 1-naphthyl phosphate hydrate Formula: C10H9CaO5P MolecularWeight: 280.227221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OP(=O)([O-])[O-].O.[Ca+2]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OP(=O)([O-])[O-].O.[Ca+2]

InChI

InChI=1S/C10H9O4P.Ca.H2O/c11-15(12,13)14-10-7-3-5-8-4-1-2-6-9(8)10;;/h1-7H,(H2,11,12,13);;1H2/q;+2;/p-2