3-nitro-4-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]benzamide

Systemtic Name: 3-nitro-4-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]benzamide Openeye Name: 3-nitro-4-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]benzamide CAS Name: 3-nitro-4-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]benzamide IUPAC Name: 3-nitro-4-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]benzamide Traditional Name: 3-nitro-4-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]benzamide Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C23H30N2O5/c1-22(2,3)15-23(4,5)17-7-9-18(10-8-17)29-12-13-30-20-11-6-16(21(24)26)14-19(20)25(27)28/h6-11,14H,12-13,15H2,1-5H3,(H2,24,26)