N-[2-(2-methylpropanoylamino)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1CCN(CC1)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1CCN(CC1)C(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H29N3O3/c1-16(2)20(26)22-12-13-23-21(27)18-10-14-24(15-11-18)19(25)9-8-17-6-4-3-5-7-17/h3-9,16,18H,10-15H2,1-2H3,(H,22,26)(H,23,27)/b9-8+