3-chloranyl-3-methyl-4-nitro-but-1-ene

Systemtic Name: 3-chloranyl-3-methyl-4-nitro-but-1-ene Openeye Name: 3-chloro-3-methyl-4-nitro-but-1-ene CAS Name: 3-chloro-3-methyl-4-nitro-1-butene IUPAC Name: 3-chloro-3-methyl-4-nitrobut-1-ene Traditional Name: 3-chloro-3-methyl-4-nitro-but-1-ene Formula: C5H8ClNO2 MolecularWeight: 149.57552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8ClNO2/c1-3-5(2,6)4-7(8)9/h3H,1,4H2,2H3