azepan-1-yl-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone

Systemtic Name: azepan-1-yl-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Openeye Name: azepan-1-yl-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone CAS Name: 1-azepanyl-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]methanone IUPAC Name: azepan-1-yl-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Traditional Name: azepan-1-yl-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Formula: C18H23N3O MolecularWeight: 297.39472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O/c1-14-13-15(2)21(19-14)17-9-7-16(8-10-17)18(22)20-11-5-3-4-6-12-20/h7-10,13H,3-6,11-12H2,1-2H3