2-butyl-7-chloranyl-3,4-dihydro-1,3,4-benzotriazepin-5-one

Systemtic Name: 2-butyl-7-chloranyl-3,4-dihydro-1,3,4-benzotriazepin-5-one Openeye Name: 2-butyl-7-chloro-3,4-dihydro-1,3,4-benzotriazepin-5-one CAS Name: 2-butyl-7-chloro-3,4-dihydro-1,3,4-benzotriazepin-5-one IUPAC Name: 2-butyl-7-chloro-3,4-dihydro-1,3,4-benzotriazepin-5-one Traditional Name: 2-butyl-7-chloro-3,4-dihydro-1,3,4-benzotriazepin-5-one Formula: C12H14ClN3O MolecularWeight: 251.71206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C(C=C2)Cl)C(=O)NN1

Isomeric SMILES

CCCCC1=NC2=C(C=C(C=C2)Cl)C(=O)NN1

InChI

InChI=1S/C12H14ClN3O/c1-2-3-4-11-14-10-6-5-8(13)7-9(10)12(17)16-15-11/h5-7H,2-4H2,1H3,(H,14,15)(H,16,17)