N-(4-ethoxy-2-nitro-phenyl)-2-[3-(3-methylbutoxy)phenoxy]ethanamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-2-[3-(3-methylbutoxy)phenoxy]ethanamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-2-(3-isopentyloxyphenoxy)acetamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-2-[3-(3-methylbutoxy)phenoxy]acetamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-2-[3-(3-methylbutoxy)phenoxy]acetamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-2-(3-isoamoxyphenoxy)acetamide Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)COC2=CC(=CC=C2)OCCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)COC2=CC(=CC=C2)OCCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O6/c1-4-27-18-8-9-19(20(13-18)23(25)26)22-21(24)14-29-17-7-5-6-16(12-17)28-11-10-15(2)3/h5-9,12-13,15H,4,10-11,14H2,1-3H3,(H,22,24)