2,9-dimethyl-1,10-phenanthroline dihydrate

Systemtic Name: 2,9-dimethyl-1,10-phenanthroline dihydrate Openeye Name: 2,9-dimethyl-1,10-phenanthroline dihydrate CAS Name: 2,9-dimethyl-1,10-phenanthroline dihydrate IUPAC Name: 2,9-dimethyl-1,10-phenanthroline dihydrate Traditional Name: 2,9-dimethyl-1,10-phenanthroline dihydrate Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=CC3=C2N=C(C=C3)C.O.O

Isomeric SMILES

CC1=NC2=C(C=C1)C=CC3=C2N=C(C=C3)C.O.O

InChI

InChI=1S/C14H12N2.2H2O/c1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9;;/h3-8H,1-2H3;2*1H2