bicyclo[3.1.0]hexa-1(6),2,4-triene; 2-ethanoyl-1-methyl-pyrrole-3-carboxylic acid

Systemtic Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 2-ethanoyl-1-methyl-pyrrole-3-carboxylic acid Openeye Name: 2-acetyl-1-methyl-pyrrole-3-carboxylic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: 2-acetyl-1-methyl-3-pyrrolecarboxylic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: 2-acetyl-1-methylpyrrole-3-carboxylic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: 2-acetyl-1-methyl-pyrrole-3-carboxylic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C14H13NO3 MolecularWeight: 243.25792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CN1C)C(=O)O.C1=CC2=CC2=C1

Isomeric SMILES

CC(=O)C1=C(C=CN1C)C(=O)O.C1=CC2=CC2=C1

InChI

InChI=1S/C8H9NO3.C6H4/c1-5(10)7-6(8(11)12)3-4-9(7)2;1-2-5-4-6(5)3-1/h3-4H,1-2H3,(H,11,12);1-4H