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

Systemtic Name: N-[1-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]-4-piperidyl]-4-fluoro-benzamide Formula: C21H23ClFN3O3 MolecularWeight: 419.877023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H23ClFN3O3/c1-29-19-7-6-17(12-18(19)22)24-20(27)13-26-10-8-16(9-11-26)25-21(28)14-2-4-15(23)5-3-14/h2-7,12,16H,8-11,13H2,1H3,(H,24,27)(H,25,28)