(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-(4-phenylmethoxypiperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-(4-phenylmethoxypiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-benzyloxy-1-piperidyl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-(4-phenylmethoxy-1-piperidinyl)-2-propen-1-one IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-(4-phenylmethoxypiperidin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzoxypiperidino)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)N3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)N3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O2/c1-20-25(21(2)29(27-20)23-11-7-4-8-12-23)13-14-26(30)28-17-15-24(16-18-28)31-19-22-9-5-3-6-10-22/h3-14,24H,15-19H2,1-2H3/b14-13+