(5Z,9aZ,11Z)-3H-pyrimido[2,1-b][1,3]benzodiazocine

Systemtic Name: (5Z,9aZ,11Z)-3H-pyrimido[2,1-b][1,3]benzodiazocine Openeye Name: (5Z,9aZ,11Z)-3H-pyrimido[2,1-b][1,3]benzodiazocine CAS Name: (5Z,9aZ,11Z)-3H-pyrimido[2,1-b][1,3]benzodiazocine IUPAC Name: (5Z,9aZ,11Z)-3H-pyrimido[2,1-b][1,3]benzodiazocine Traditional Name: (5Z,9aZ,11Z)-3H-pyrimido[2,1-b][1,3]benzodiazocine Formula: C13H11N3 MolecularWeight: 209.24654

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN2C=CC=C3C=CC=CC3=NC2=N1

Isomeric SMILES

C1C=CN2/C=C\C=C/3\C=CC=C\C3=N\C2=N1

InChI

InChI=1S/C13H11N3/c1-2-7-12-11(5-1)6-3-9-16-10-4-8-14-13(16)15-12/h1-7,9-10H,8H2/b9-3-,11-6-,15-12-