4-[4-(2-methylbutan-2-yl)phenoxy]-3-nitro-benzamide

Systemtic Name: 4-[4-(2-methylbutan-2-yl)phenoxy]-3-nitro-benzamide Openeye Name: 4-[4-(1,1-dimethylpropyl)phenoxy]-3-nitro-benzamide CAS Name: 4-[4-(2-methylbutan-2-yl)phenoxy]-3-nitrobenzamide IUPAC Name: 4-[4-(2-methylbutan-2-yl)phenoxy]-3-nitrobenzamide Traditional Name: 4-(4-tert-amylphenoxy)-3-nitro-benzamide Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4/c1-4-18(2,3)13-6-8-14(9-7-13)24-16-10-5-12(17(19)21)11-15(16)20(22)23/h5-11H,4H2,1-3H3,(H2,19,21)