3-[(4-chloranyl-2-nitro-phenyl)-methyl-amino]propanenitrile

Systemtic Name: 3-[(4-chloranyl-2-nitro-phenyl)-methyl-amino]propanenitrile Openeye Name: 3-(4-chloro-N-methyl-2-nitro-anilino)propanenitrile CAS Name: 3-(4-chloro-N-methyl-2-nitroanilino)propanenitrile IUPAC Name: 3-(4-chloro-N-methyl-2-nitroanilino)propanenitrile Traditional Name: 3-(4-chloro-N-methyl-2-nitro-anilino)propionitrile Formula: C10H10ClN3O2 MolecularWeight: 239.6583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN3O2/c1-13(6-2-5-12)9-4-3-8(11)7-10(9)14(15)16/h3-4,7H,2,6H2,1H3