4-azabicyclo[3.1.0]hexa-1(6),2,4-triene; 2-methylidene-3-oxidanylidene-hexanoic acid

Systemtic Name: 4-azabicyclo[3.1.0]hexa-1(6),2,4-triene; 2-methylidene-3-oxidanylidene-hexanoic acid Openeye Name: 4-azabicyclo[3.1.0]hexa-1(6),2,4-triene; 2-methylene-3-oxo-hexanoic acid CAS Name: 4-azabicyclo[3.1.0]hexa-1(6),2,4-triene; 2-methylene-3-oxohexanoic acid IUPAC Name: 4-azabicyclo[3.1.0]hexa-1(6),2,4-triene; 2-methylidene-3-oxohexanoic acid Traditional Name: 4-azabicyclo[3.1.0]hexa-1(6),2,4-triene; 2-butyrylacrylic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(=C)C(=O)O.C1=CN=C2C1=C2

Isomeric SMILES

CCCC(=O)C(=C)C(=O)O.C1=CN=C2C1=C2

InChI

InChI=1S/C7H10O3.C5H3N/c1-3-4-6(8)5(2)7(9)10;1-2-6-5-3-4(1)5/h2-4H2,1H3,(H,9,10);1-3H