3-nitro-4-[4-(3-oxidanylidenebutyl)phenoxy]benzamide

Systemtic Name: 3-nitro-4-[4-(3-oxidanylidenebutyl)phenoxy]benzamide Openeye Name: 3-nitro-4-[4-(3-oxobutyl)phenoxy]benzamide CAS Name: 3-nitro-4-[4-(3-oxobutyl)phenoxy]benzamide IUPAC Name: 3-nitro-4-[4-(3-oxobutyl)phenoxy]benzamide Traditional Name: 4-[4-(3-ketobutyl)phenoxy]-3-nitro-benzamide Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-11(20)2-3-12-4-7-14(8-5-12)24-16-9-6-13(17(18)21)10-15(16)19(22)23/h4-10H,2-3H2,1H3,(H2,18,21)