N-(3,4-dimethoxyphenyl)-1-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]piperidine-2-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-1-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]piperidine-2-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-1-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]piperidine-2-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-1-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-piperidinecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-1-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]piperidine-2-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-1-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]pipecolinamide Formula: C22H24N4O7 MolecularWeight: 456.44856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCCCN2N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCCCN2/N=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4)OC

InChI

InChI=1S/C22H24N4O7/c1-30-18-7-6-15(10-19(18)31-2)24-22(27)16-5-3-4-8-25(16)23-12-14-9-20-21(33-13-32-20)11-17(14)26(28)29/h6-7,9-12,16H,3-5,8,13H2,1-2H3,(H,24,27)/b23-12+