1-[2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]ethanoyl]piperidine-3-carboxamide

Systemtic Name: 1-[2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]ethanoyl]piperidine-3-carboxamide Openeye Name: 1-[2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]acetyl]piperidine-3-carboxamide CAS Name: 1-[2-[2-(4-methoxyphenyl)-4-nitrophenoxy]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: 1-[2-[2-(4-methoxyphenyl)-4-nitrophenoxy]acetyl]piperidine-3-carboxamide Traditional Name: 1-[2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]acetyl]nipecotamide Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OCC(=O)N3CCCC(C3)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OCC(=O)N3CCCC(C3)C(=O)N

InChI

InChI=1S/C21H23N3O6/c1-29-17-7-4-14(5-8-17)18-11-16(24(27)28)6-9-19(18)30-13-20(25)23-10-2-3-15(12-23)21(22)26/h4-9,11,15H,2-3,10,12-13H2,1H3,(H2,22,26)