azepan-1-yl-[1-[(2-chloranyl-5-methyl-phenoxy)methyl]pyrazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-[(2-chloranyl-5-methyl-phenoxy)methyl]pyrazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-[(2-chloro-5-methyl-phenoxy)methyl]pyrazol-3-yl]methanone CAS Name: 1-azepanyl-[1-[(2-chloro-5-methylphenoxy)methyl]-3-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[1-[(2-chloro-5-methylphenoxy)methyl]pyrazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-[(2-chloro-5-methyl-phenoxy)methyl]pyrazol-3-yl]methanone Formula: C18H22ClN3O2 MolecularWeight: 347.83918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCN2C=CC(=N2)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCN2C=CC(=N2)C(=O)N3CCCCCC3

InChI

InChI=1S/C18H22ClN3O2/c1-14-6-7-15(19)17(12-14)24-13-22-11-8-16(20-22)18(23)21-9-4-2-3-5-10-21/h6-8,11-12H,2-5,9-10,13H2,1H3