N-[2-(butan-2-ylamino)-2-oxidanylidene-1-[1-(3-phenylpropanoyl)piperidin-4-yl]ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-(butan-2-ylamino)-2-oxidanylidene-1-[1-(3-phenylpropanoyl)piperidin-4-yl]ethyl]-4-fluoranyl-benzamide Openeye Name: 4-fluoro-N-[2-oxo-1-[1-(3-phenylpropanoyl)-4-piperidyl]-2-(sec-butylamino)ethyl]benzamide CAS Name: N-[2-(butan-2-ylamino)-2-oxo-1-[1-(1-oxo-3-phenylpropyl)-4-piperidinyl]ethyl]-4-fluorobenzamide IUPAC Name: N-[2-(butan-2-ylamino)-2-oxo-1-[1-(3-phenylpropanoyl)piperidin-4-yl]ethyl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[1-(1-hydrocinnamoyl-4-piperidyl)-2-keto-2-(sec-butylamino)ethyl]benzamide Formula: C27H34FN3O3 MolecularWeight: 467.575563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(C1CCN(CC1)C(=O)CCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)NC(=O)C(C1CCN(CC1)C(=O)CCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C27H34FN3O3/c1-3-19(2)29-27(34)25(30-26(33)22-10-12-23(28)13-11-22)21-15-17-31(18-16-21)24(32)14-9-20-7-5-4-6-8-20/h4-8,10-13,19,21,25H,3,9,14-18H2,1-2H3,(H,29,34)(H,30,33)