3-nitro-4-[(4-propanoylphenoxy)methyl]benzamide

Systemtic Name: 3-nitro-4-[(4-propanoylphenoxy)methyl]benzamide Openeye Name: 3-nitro-4-[(4-propanoylphenoxy)methyl]benzamide CAS Name: 3-nitro-4-[[4-(1-oxopropyl)phenoxy]methyl]benzamide IUPAC Name: 3-nitro-4-[(4-propanoylphenoxy)methyl]benzamide Traditional Name: 3-nitro-4-[(4-propionylphenoxy)methyl]benzamide Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-2-16(20)11-5-7-14(8-6-11)24-10-13-4-3-12(17(18)21)9-15(13)19(22)23/h3-9H,2,10H2,1H3,(H2,18,21)