disodium (2E)-1-methoxy-2-[(1-phosphorosooxynaphthalen-2-yl)methylidene]adamantane

Systemtic Name: disodium (2E)-1-methoxy-2-[(1-phosphorosooxynaphthalen-2-yl)methylidene]adamantane Openeye Name: disodium (2E)-1-methoxy-2-[(1-phosphorosooxy-2-naphthyl)methylene]adamantane CAS Name: disodium (2E)-1-methoxy-2-[(1-phosphorosooxy-2-naphthalenyl)methylidene]adamantane IUPAC Name: disodium (2E)-1-methoxy-2-[(1-phosphorosooxynaphthalen-2-yl)methylidene]adamantane Traditional Name: disodium (2E)-1-methoxy-2-[(1-phosphorosooxy-2-naphthyl)methylene]adamantane Formula: C22H23Na2O3P+2 MolecularWeight: 412.369521

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Descriptors Computed from Structure

Canonical SMILES:

COC12CC3CC(C1)CC(C3)C2=CC4=C(C5=CC=CC=C5C=C4)OP=O.[Na+].[Na+]

Isomeric SMILES

COC1\2CC3CC(C1)CC(C3)/C2=C\C4=C(C5=CC=CC=C5C=C4)OP=O.[Na+].[Na+]

InChI

InChI=1S/C22H23O3P.2Na/c1-24-22-12-14-8-15(13-22)10-18(9-14)20(22)11-17-7-6-16-4-2-3-5-19(16)21(17)25-26-23;;/h2-7,11,14-15,18H,8-10,12-13H2,1H3;;/q;2*+1/b20-11+;;