3-methyl-4H-1,3,4-benzotriazepin-2-one

Systemtic Name: 3-methyl-4H-1,3,4-benzotriazepin-2-one Openeye Name: 3-methyl-4H-1,3,4-benzotriazepin-2-one CAS Name: 3-methyl-4H-1,3,4-benzotriazepin-2-one IUPAC Name: 3-methyl-4H-1,3,4-benzotriazepin-2-one Traditional Name: 3-methyl-4H-1,3,4-benzotriazepin-2-one Formula: C9H9N3O MolecularWeight: 175.18726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N=C2C=CC=CC2=CN1

Isomeric SMILES

CN1C(=O)N=C2C=CC=CC2=CN1

InChI

InChI=1S/C9H9N3O/c1-12-9(13)11-8-5-3-2-4-7(8)6-10-12/h2-6,10H,1H3