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

Systemtic Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; methyl 2-ethanoyl-1-ethyl-pyrrole-3-carboxylate Openeye Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; methyl 2-acetyl-1-ethyl-pyrrole-3-carboxylate CAS Name: 2-acetyl-1-ethyl-3-pyrrolecarboxylic acid methyl ester; bicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; methyl 2-acetyl-1-ethylpyrrole-3-carboxylate Traditional Name: 2-acetyl-1-ethyl-pyrrole-3-carboxylic acid methyl ester; bicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C16H17NO3 MolecularWeight: 271.31108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=C1C(=O)C)C(=O)OC.C1=CC2=CC2=C1

Isomeric SMILES

CCN1C=CC(=C1C(=O)C)C(=O)OC.C1=CC2=CC2=C1

InChI

InChI=1S/C10H13NO3.C6H4/c1-4-11-6-5-8(10(13)14-3)9(11)7(2)12;1-2-5-4-6(5)3-1/h5-6H,4H2,1-3H3;1-4H