4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one

Systemtic Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one Openeye Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one CAS Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one IUPAC Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one Traditional Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one Formula: C16H15N3O MolecularWeight: 265.3098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C=NNC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C=NNC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H15N3O/c1-11-6-5-7-12(2)15(11)19-10-17-18-14-9-4-3-8-13(14)16(19)20/h3-10,18H,1-2H3