(E)-1-[4-(phenylcarbonyl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(phenylcarbonyl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-benzoyl-1-piperidyl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(4-benzoyl-1-piperidinyl)-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(4-benzoylpiperidin-1-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzoylpiperidino)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)C=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O2/c28-23(12-11-19-17-25-27(18-19)22-9-5-2-6-10-22)26-15-13-21(14-16-26)24(29)20-7-3-1-4-8-20/h1-12,17-18,21H,13-16H2/b12-11+