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

Systemtic Name: sodium 1,3,6-trimethyl-4-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol Openeye Name: sodium 1,3,6-trimethyl-4-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol CAS Name: sodium 1,3,6-trimethyl-4-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol IUPAC Name: sodium 1,3,6-trimethyl-4-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol Traditional Name: sodium 1,3,6-trimethyl-4-phenyl-1,5-diaza-2-azanidacyclohept-4-en-3-ol Formula: C13H18N3NaO MolecularWeight: 255.29129

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N3O.Na/c1-10-9-16(3)15-13(2,17)12(14-10)11-7-5-4-6-8-11;/h4-8,10,17H,9H2,1-3H3;/q-1;+1