4-chloranyl-N-(2-cyanoethyl)-N-methyl-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2-cyanoethyl)-N-methyl-3-nitro-benzamide Openeye Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitro-benzamide CAS Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitrobenzamide IUPAC Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitrobenzamide Traditional Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitro-benzamide Formula: C11H10ClN3O3 MolecularWeight: 267.6684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClN3O3/c1-14(6-2-5-13)11(16)8-3-4-9(12)10(7-8)15(17)18/h3-4,7H,2,6H2,1H3