bicyclo[2.2.0]hexa-1(4),2,5-trien-3-ol; 4-methylpentanenitrile

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-trien-3-ol; 4-methylpentanenitrile Openeye Name: bicyclo[2.2.0]hexa-1(4),2,5-trien-3-ol; 4-methylpentanenitrile CAS Name: 3-bicyclo[2.2.0]hexa-1(4),2,5-trienol; 4-methylpentanenitrile IUPAC Name: bicyclo[2.2.0]hexa-1(4),2,5-trien-3-ol; 4-methylpentanenitrile Traditional Name: bicyclo[2.2.0]hexa-1(4),2,5-trien-3-ol; 4-methylvaleronitrile Formula: C12H15NO MolecularWeight: 189.2536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC#N.C1=CC2=C1C=C2O

Isomeric SMILES

CC(C)CCC#N.C1=CC2=C1C=C2O

InChI

InChI=1S/C6H11N.C6H4O/c1-6(2)4-3-5-7;7-6-3-4-1-2-5(4)6/h6H,3-4H2,1-2H3;1-3,7H