sodium 1,6-dimethyl-3-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol

Systemtic Name: sodium 1,6-dimethyl-3-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol Openeye Name: sodium 1,6-dimethyl-3-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol CAS Name: sodium 1,6-dimethyl-3-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol IUPAC Name: sodium 1,6-dimethyl-3-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol Traditional Name: sodium 1,6-dimethyl-3-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol Formula: C12H16N3NaO MolecularWeight: 241.26471

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN([N-]C(C=N1)(C2=CC=CC=C2)O)C.[Na+]

Isomeric SMILES

CC1CN([N-]C(C=N1)(C2=CC=CC=C2)O)C.[Na+]

InChI

InChI=1S/C12H16N3O.Na/c1-10-8-15(2)14-12(16,9-13-10)11-6-4-3-5-7-11;/h3-7,9-10,16H,8H2,1-2H3;/q-1;+1