3-ethanoyl-2-(4-methylphenyl)-4H-1,3,4-benzotriazepin-5-one

Systemtic Name: 3-ethanoyl-2-(4-methylphenyl)-4H-1,3,4-benzotriazepin-5-one Openeye Name: 3-acetyl-2-(p-tolyl)-4H-1,3,4-benzotriazepin-5-one CAS Name: 3-acetyl-2-(4-methylphenyl)-4H-1,3,4-benzotriazepin-5-one IUPAC Name: 3-acetyl-2-(4-methylphenyl)-4H-1,3,4-benzotriazepin-5-one Traditional Name: 3-acetyl-2-(p-tolyl)-4H-1,3,4-benzotriazepin-5-one Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)NN2C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)NN2C(=O)C

InChI

InChI=1S/C17H15N3O2/c1-11-7-9-13(10-8-11)16-18-15-6-4-3-5-14(15)17(22)19-20(16)12(2)21/h3-10H,1-2H3,(H,19,22)