3-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; pent-1-yne

Systemtic Name: 3-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; pent-1-yne Openeye Name: 3-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; pent-1-yne CAS Name: 3-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; 1-pentyne IUPAC Name: 3-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; pent-1-yne Traditional Name: 3-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; pent-1-yne Formula: C11H11NO2 MolecularWeight: 189.21054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#C.C1=C2C1=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC#C.C1=C2C1=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C6H3NO2.C5H8/c8-7(9)6-2-4-1-5(4)3-6;1-3-5-4-2/h1-3H;1H,4-5H2,2H3