trimethyl (1Z,2Z,4E)-3-pyrrolidin-1-ylcycloundeca-2,4,11-triene-1,2,4-tricarboxylate

Systemtic Name: trimethyl (1Z,2Z,4E)-3-pyrrolidin-1-ylcycloundeca-2,4,11-triene-1,2,4-tricarboxylate Openeye Name: trimethyl (1Z,2Z,4E)-3-pyrrolidin-1-ylcycloundeca-2,4,11-triene-1,2,4-tricarboxylate CAS Name: (1Z,2Z,4E)-3-(1-pyrrolidinyl)cycloundeca-2,4,11-triene-1,2,4-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (1Z,2Z,4E)-3-pyrrolidin-1-ylcycloundeca-2,4,11-triene-1,2,4-tricarboxylate Traditional Name: (1Z,2Z,4E)-3-pyrrolidinocycloundeca-2,4,11-triene-1,2,4-tricarboxylic acid trimethyl ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCCCCCC=C(C(=C1C(=O)OC)N2CCCC2)C(=O)OC

Isomeric SMILES

COC(=O)/C/1=C\CCCCC/C=C(/C(=C1/C(=O)OC)/N2CCCC2)/C(=O)OC

InChI

InChI=1S/C21H29NO6/c1-26-19(23)15-11-7-5-4-6-8-12-16(20(24)27-2)18(17(15)21(25)28-3)22-13-9-10-14-22/h11-12H,4-10,13-14H2,1-3H3/b15-11-,16-12+,18-17-