4-(3-methyl-5-propan-2-yl-phenoxy)-3-nitro-benzamide

Systemtic Name: 4-(3-methyl-5-propan-2-yl-phenoxy)-3-nitro-benzamide Openeye Name: 4-(3-isopropyl-5-methyl-phenoxy)-3-nitro-benzamide CAS Name: 4-(3-methyl-5-propan-2-ylphenoxy)-3-nitrobenzamide IUPAC Name: 4-(3-methyl-5-propan-2-ylphenoxy)-3-nitrobenzamide Traditional Name: 4-(3-isopropyl-5-methyl-phenoxy)-3-nitro-benzamide Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C17H18N2O4/c1-10(2)13-6-11(3)7-14(8-13)23-16-5-4-12(17(18)20)9-15(16)19(21)22/h4-10H,1-3H3,(H2,18,20)