azepan-1-yl-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-1-(o-tolyl)pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[5-methyl-1-(2-methylphenyl)-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-1-(o-tolyl)pyrazol-4-yl]methanone Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C18H23N3O/c1-14-9-5-6-10-17(14)21-15(2)16(13-19-21)18(22)20-11-7-3-4-8-12-20/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3