3,3-dimethyl-1-nitro-but-1-yne

Systemtic Name: 3,3-dimethyl-1-nitro-but-1-yne Openeye Name: 3,3-dimethyl-1-nitro-but-1-yne CAS Name: 3,3-dimethyl-1-nitro-1-butyne IUPAC Name: 3,3-dimethyl-1-nitrobut-1-yne Traditional Name: 3,3-dimethyl-1-nitro-but-1-yne Formula: C6H9NO2 MolecularWeight: 127.14116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H9NO2/c1-6(2,3)4-5-7(8)9/h1-3H3