N-(3-fluoranyl-4-methyl-phenyl)-N-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-N-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-N-[1-[(4-nitrophenyl)methyl]-4-piperidyl]acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-N-[1-[(4-nitrophenyl)methyl]-4-piperidinyl]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-N-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]acetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-N-[1-(4-nitrobenzyl)-4-piperidyl]acetamide Formula: C21H24FN3O3 MolecularWeight: 385.431963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C)F

InChI

InChI=1S/C21H24FN3O3/c1-15-3-6-20(13-21(15)22)24(16(2)26)18-9-11-23(12-10-18)14-17-4-7-19(8-5-17)25(27)28/h3-8,13,18H,9-12,14H2,1-2H3