N-[1-[2-[(4-acetamido-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[2-[(4-acetamido-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[2-(4-acetamido-3-chloro-anilino)-2-oxo-ethyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[2-(4-acetamido-3-chloroanilino)-2-oxoethyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[2-(4-acetamido-3-chloroanilino)-2-oxoethyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[2-(4-acetamido-3-chloro-anilino)-2-keto-ethyl]-4-piperidyl]-4-fluoro-benzamide Formula: C22H24ClFN4O3 MolecularWeight: 446.902363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C22H24ClFN4O3/c1-14(29)25-20-7-6-18(12-19(20)23)26-21(30)13-28-10-8-17(9-11-28)27-22(31)15-2-4-16(24)5-3-15/h2-7,12,17H,8-11,13H2,1H3,(H,25,29)(H,26,30)(H,27,31)