N-(4-chloranyl-2,5-dimethoxy-phenyl)-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-5-nitro-2-piperidino-benzamide Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)OC)Cl

InChI

InChI=1S/C20H22ClN3O5/c1-28-18-12-16(19(29-2)11-15(18)21)22-20(25)14-10-13(24(26)27)6-7-17(14)23-8-4-3-5-9-23/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,22,25)