1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]-N,N-dimethyl-piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]-N,N-dimethyl-piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]-N,N-dimethyl-piperidine-4-carboxamide CAS Name: 1-[(E)-3-(1,3-diphenyl-4-pyrazolyl)-1-oxoprop-2-enyl]-N,N-dimethyl-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]-N,N-dimethylpiperidine-4-carboxamide Traditional Name: 1-[(E)-3-(1,3-diphenylpyrazol-4-yl)acryloyl]-N,N-dimethyl-isonipecotamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCN(CC1)C(=O)C=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)C1CCN(CC1)C(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O2/c1-28(2)26(32)21-15-17-29(18-16-21)24(31)14-13-22-19-30(23-11-7-4-8-12-23)27-25(22)20-9-5-3-6-10-20/h3-14,19,21H,15-18H2,1-2H3/b14-13+