2-ethoxy-N-(1-methyl-4-propyl-pyrrol-3-yl)-5-nitro-benzamide

Systemtic Name: 2-ethoxy-N-(1-methyl-4-propyl-pyrrol-3-yl)-5-nitro-benzamide Openeye Name: 2-ethoxy-N-(1-methyl-4-propyl-pyrrol-3-yl)-5-nitro-benzamide CAS Name: 2-ethoxy-N-(1-methyl-4-propyl-3-pyrrolyl)-5-nitrobenzamide IUPAC Name: 2-ethoxy-N-(1-methyl-4-propylpyrrol-3-yl)-5-nitrobenzamide Traditional Name: 2-ethoxy-N-(1-methyl-4-propyl-pyrrol-3-yl)-5-nitro-benzamide Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN(C=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OCC)C

Isomeric SMILES

CCCC1=CN(C=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OCC)C

InChI

InChI=1S/C17H21N3O4/c1-4-6-12-10-19(3)11-15(12)18-17(21)14-9-13(20(22)23)7-8-16(14)24-5-2/h7-11H,4-6H2,1-3H3,(H,18,21)