2,3-dimethyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1,9-dicarboxylate

Systemtic Name: 2,3-dimethyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1,9-dicarboxylate Openeye Name: 2,3-dimethyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1,9-dicarboxylate CAS Name: 2,3-dimethyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1,9-dicarboxylate IUPAC Name: 2,3-dimethyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1,9-dicarboxylate Traditional Name: 2,3-dimethyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-1,9-dicarboxylate Formula: C13H15NO4-2 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2CCCCC(C2=C1C(=O)[O-])C(=O)[O-])C

Isomeric SMILES

CC1=C(N2CCCCC(C2=C1C(=O)[O-])C(=O)[O-])C

InChI

InChI=1S/C13H17NO4/c1-7-8(2)14-6-4-3-5-9(12(15)16)11(14)10(7)13(17)18/h9H,3-6H2,1-2H3,(H,15,16)(H,17,18)/p-2