1-(azepan-1-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethane-1,2-dione

Systemtic Name: 1-(azepan-1-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethane-1,2-dione Openeye Name: 1-(azepan-1-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethane-1,2-dione CAS Name: 1-(1-azepanyl)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)ethane-1,2-dione IUPAC Name: 1-(azepan-1-yl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)ethane-1,2-dione Traditional Name: 1-(azepan-1-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethane-1,2-dione Formula: C19H23N3O2 MolecularWeight: 325.40482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N3CCCCCC3

InChI

InChI=1S/C19H23N3O2/c1-14-17(15(2)22(20-14)16-10-6-5-7-11-16)18(23)19(24)21-12-8-3-4-9-13-21/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3