azepan-1-yl-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-(1-benzyl-3-methyl-pyrazol-4-yl)methanone CAS Name: 1-azepanyl-[3-methyl-1-(phenylmethyl)-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-(1-benzyl-3-methylpyrazol-4-yl)methanone Traditional Name: azepan-1-yl-(1-benzyl-3-methyl-pyrazol-4-yl)methanone Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)N2CCCCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1C(=O)N2CCCCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N3O/c1-15-17(18(22)20-11-7-2-3-8-12-20)14-21(19-15)13-16-9-5-4-6-10-16/h4-6,9-10,14H,2-3,7-8,11-13H2,1H3