N-(3,4-diethoxyphenyl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(3,4-diethoxyphenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(3,4-diethoxyphenyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(3,4-diethoxyphenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(3,4-diethoxyphenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(3,4-diethoxyphenyl)-3-nitro-4-piperidino-benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])OCC

InChI

InChI=1S/C22H27N3O5/c1-3-29-20-11-9-17(15-21(20)30-4-2)23-22(26)16-8-10-18(19(14-16)25(27)28)24-12-6-5-7-13-24/h8-11,14-15H,3-7,12-13H2,1-2H3,(H,23,26)