N-[1-(ethoxymethoxy)-4-(oxidanylcarbamoyl)pent-4-en-2-yl]-4-nitro-benzamide

Systemtic Name: N-[1-(ethoxymethoxy)-4-(oxidanylcarbamoyl)pent-4-en-2-yl]-4-nitro-benzamide Openeye Name: N-[1-(ethoxymethoxymethyl)-3-(hydroxycarbamoyl)but-3-enyl]-4-nitro-benzamide CAS Name: N-[1-(ethoxymethoxy)-4-[(hydroxyamino)-oxomethyl]pent-4-en-2-yl]-4-nitrobenzamide IUPAC Name: N-[1-(ethoxymethoxy)-4-(hydroxycarbamoyl)pent-4-en-2-yl]-4-nitrobenzamide Traditional Name: N-[1-(ethoxymethoxymethyl)-3-(hydroxycarbamoyl)but-3-enyl]-4-nitro-benzamide Formula: C16H21N3O7 MolecularWeight: 367.35384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCOCC(CC(=C)C(=O)NO)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOCOCC(CC(=C)C(=O)NO)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O7/c1-3-25-10-26-9-13(8-11(2)15(20)18-22)17-16(21)12-4-6-14(7-5-12)19(23)24/h4-7,13,22H,2-3,8-10H2,1H3,(H,17,21)(H,18,20)