N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-fluoranyl-4-methyl-5-nitro-benzamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-fluoranyl-4-methyl-5-nitro-benzamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidyl]-3-fluoro-4-methyl-5-nitro-benzamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidinyl]-3-fluoro-4-methyl-5-nitrobenzamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-fluoro-4-methyl-5-nitrobenzamide Traditional Name: N-[1-(4-chlorobenzyl)-4-piperidyl]-3-fluoro-4-methyl-5-nitro-benzamide Formula: C20H21ClFN3O3 MolecularWeight: 405.850443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C(=O)NC2CCN(CC2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1F)C(=O)NC2CCN(CC2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClFN3O3/c1-13-18(22)10-15(11-19(13)25(27)28)20(26)23-17-6-8-24(9-7-17)12-14-2-4-16(21)5-3-14/h2-5,10-11,17H,6-9,12H2,1H3,(H,23,26)