azepan-1-yl-(1-methyl-3-phenyl-pyrazol-4-yl)methanone

Systemtic Name: azepan-1-yl-(1-methyl-3-phenyl-pyrazol-4-yl)methanone Openeye Name: azepan-1-yl-(1-methyl-3-phenyl-pyrazol-4-yl)methanone CAS Name: 1-azepanyl-(1-methyl-3-phenyl-4-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(1-methyl-3-phenylpyrazol-4-yl)methanone Traditional Name: azepan-1-yl-(1-methyl-3-phenyl-pyrazol-4-yl)methanone Formula: C17H21N3O MolecularWeight: 283.36814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C17H21N3O/c1-19-13-15(16(18-19)14-9-5-4-6-10-14)17(21)20-11-7-2-3-8-12-20/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3