azepan-1-yl-[3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[3-(2,5-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[3-(2,5-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NN(C=C2C(=O)N3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NN(C=C2C(=O)N3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3/c1-29-19-12-13-22(30-2)20(16-19)23-21(24(28)26-14-8-3-4-9-15-26)17-27(25-23)18-10-6-5-7-11-18/h5-7,10-13,16-17H,3-4,8-9,14-15H2,1-2H3