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

Systemtic Name: N-[1-[(2-chloranyl-5-nitro-phenyl)methyl]piperidin-4-yl]-N-(4-fluorophenyl)-2-methoxy-ethanamide Openeye Name: N-[1-[(2-chloro-5-nitro-phenyl)methyl]-4-piperidyl]-N-(4-fluorophenyl)-2-methoxy-acetamide CAS Name: N-[1-[(2-chloro-5-nitrophenyl)methyl]-4-piperidinyl]-N-(4-fluorophenyl)-2-methoxyacetamide IUPAC Name: N-[1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl]-N-(4-fluorophenyl)-2-methoxyacetamide Traditional Name: N-[1-(2-chloro-5-nitro-benzyl)-4-piperidyl]-N-(4-fluorophenyl)-2-methoxy-acetamide Formula: C21H23ClFN3O4 MolecularWeight: 435.876423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClFN3O4/c1-30-14-21(27)25(17-4-2-16(23)3-5-17)18-8-10-24(11-9-18)13-15-12-19(26(28)29)6-7-20(15)22/h2-7,12,18H,8-11,13-14H2,1H3