dimethyl (1R,4S)-2-butyl-7-azabicyclo[2.2.1]hepta-2,5-diene-3,7-dicarboxylate

Systemtic Name: dimethyl (1R,4S)-2-butyl-7-azabicyclo[2.2.1]hepta-2,5-diene-3,7-dicarboxylate Openeye Name: dimethyl (1R,4S)-2-butyl-7-azabicyclo[2.2.1]hepta-2,5-diene-3,7-dicarboxylate CAS Name: (1R,4S)-2-butyl-7-azabicyclo[2.2.1]hepta-2,5-diene-3,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1R,4S)-2-butyl-7-azabicyclo[2.2.1]hepta-2,5-diene-3,7-dicarboxylate Traditional Name: (1R,4S)-2-butyl-7-azabicyclo[2.2.1]hepta-2,5-diene-3,7-dicarboxylic acid dimethyl ester Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2C=CC1N2C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC1=C([C@@H]2C=C[C@H]1N2C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H19NO4/c1-4-5-6-9-10-7-8-11(12(9)13(16)18-2)15(10)14(17)19-3/h7-8,10-11H,4-6H2,1-3H3/t10-,11+/m1/s1