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

Systemtic Name: (E)-1-[4-(phenylmethyl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-benzyl-1-piperidyl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(phenylmethyl)-1-piperidinyl]-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(4-benzylpiperidin-1-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzylpiperidino)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C24H25N3O MolecularWeight: 371.4748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O/c28-24(12-11-22-18-25-27(19-22)23-9-5-2-6-10-23)26-15-13-21(14-16-26)17-20-7-3-1-4-8-20/h1-12,18-19,21H,13-17H2/b12-11+