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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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