N-(3,4-dimethoxyphenyl)-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-(3,4-dimethoxyphenyl)-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-(3,4-dimethoxyphenyl)-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-(3,4-dimethoxyphenyl)-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-(3,4-dimethoxyphenyl)-5-nitro-2-piperidino-benzamide Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)OC

InChI

InChI=1S/C20H23N3O5/c1-27-18-9-6-14(12-19(18)28-2)21-20(24)16-13-15(23(25)26)7-8-17(16)22-10-4-3-5-11-22/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,21,24)