N-[1-[(2-chloranyl-5-nitro-phenyl)methyl]piperidin-4-yl]-N-(4-fluorophenyl)-3-methyl-butanamide

Systemtic Name: N-[1-[(2-chloranyl-5-nitro-phenyl)methyl]piperidin-4-yl]-N-(4-fluorophenyl)-3-methyl-butanamide Openeye Name: N-[1-[(2-chloro-5-nitro-phenyl)methyl]-4-piperidyl]-N-(4-fluorophenyl)-3-methyl-butanamide CAS Name: N-[1-[(2-chloro-5-nitrophenyl)methyl]-4-piperidinyl]-N-(4-fluorophenyl)-3-methylbutanamide IUPAC Name: N-[1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl]-N-(4-fluorophenyl)-3-methylbutanamide Traditional Name: N-[1-(2-chloro-5-nitro-benzyl)-4-piperidyl]-N-(4-fluorophenyl)-3-methyl-butyramide Formula: C23H27ClFN3O3 MolecularWeight: 447.930183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(C1CCN(CC1)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CC(=O)N(C1CCN(CC1)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H27ClFN3O3/c1-16(2)13-23(29)27(19-5-3-18(25)4-6-19)20-9-11-26(12-10-20)15-17-14-21(28(30)31)7-8-22(17)24/h3-8,14,16,20H,9-13,15H2,1-2H3