2-chloranyl-N-(cyanomethyl)-N-(2-ethoxyethyl)-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(cyanomethyl)-N-(2-ethoxyethyl)-4-nitro-benzamide Openeye Name: 2-chloro-N-(cyanomethyl)-N-(2-ethoxyethyl)-4-nitro-benzamide CAS Name: 2-chloro-N-(cyanomethyl)-N-(2-ethoxyethyl)-4-nitrobenzamide IUPAC Name: 2-chloro-N-(cyanomethyl)-N-(2-ethoxyethyl)-4-nitrobenzamide Traditional Name: 2-chloro-N-(cyanomethyl)-N-(2-ethoxyethyl)-4-nitro-benzamide Formula: C13H14ClN3O4 MolecularWeight: 311.72096

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN(CC#N)C(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCOCCN(CC#N)C(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H14ClN3O4/c1-2-21-8-7-16(6-5-15)13(18)11-4-3-10(17(19)20)9-12(11)14/h3-4,9H,2,6-8H2,1H3