N-[3,5-bis(trifluoromethyl)phenyl]-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-1-(2-methoxyethyl)piperidine-4-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-1-(2-methoxyethyl)piperidine-4-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-1-(2-methoxyethyl)piperidine-4-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-1-(2-methoxyethyl)-4-piperidinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-1-(2-methoxyethyl)piperidine-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[[(E)-3-(4-fluorophenyl)acryloyl]amino]-1-(2-methoxyethyl)isonipecotamide Formula: C26H26F7N3O3 MolecularWeight: 561.491762

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCC(CC1)(C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

COCCN1CCC(CC1)(C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC(=O)/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C26H26F7N3O3/c1-39-13-12-36-10-8-24(9-11-36,35-22(37)7-4-17-2-5-20(27)6-3-17)23(38)34-21-15-18(25(28,29)30)14-19(16-21)26(31,32)33/h2-7,14-16H,8-13H2,1H3,(H,34,38)(H,35,37)/b7-4+