8-chloranylspiro[3,4-dihydro-1H-1,3,4-benzotriazepine-2,1'-cyclohexane]-5-one

Systemtic Name: 8-chloranylspiro[3,4-dihydro-1H-1,3,4-benzotriazepine-2,1'-cyclohexane]-5-one Openeye Name: 8-chlorospiro[3,4-dihydro-1H-1,3,4-benzotriazepine-2,1'-cyclohexane]-5-one CAS Name: 8-chloro-5-spiro[3,4-dihydro-1H-1,3,4-benzotriazepine-2,1'-cyclohexane]one IUPAC Name: 8-chlorospiro[3,4-dihydro-1H-1,3,4-benzotriazepine-2,1'-cyclohexane]-5-one Traditional Name: 8-chlorospiro[3,4-dihydro-1H-1,3,4-benzotriazepine-2,1'-cyclohexane]-5-one Formula: C13H16ClN3O MolecularWeight: 265.73864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)NC3=C(C=CC(=C3)Cl)C(=O)NN2

Isomeric SMILES

C1CCC2(CC1)NC3=C(C=CC(=C3)Cl)C(=O)NN2

InChI

InChI=1S/C13H16ClN3O/c14-9-4-5-10-11(8-9)15-13(17-16-12(10)18)6-2-1-3-7-13/h4-5,8,15,17H,1-3,6-7H2,(H,16,18)