dimethyl (4E)-9-oxidanylidene-1-(phenylmethyl)-1-azacycloundec-4-ene-2,7-dicarboxylate

Systemtic Name: dimethyl (4E)-9-oxidanylidene-1-(phenylmethyl)-1-azacycloundec-4-ene-2,7-dicarboxylate Openeye Name: dimethyl (4E)-1-benzyl-9-oxo-1-azacycloundec-4-ene-2,7-dicarboxylate CAS Name: (4E)-9-oxo-1-(phenylmethyl)-1-azacycloundec-4-ene-2,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4E)-1-benzyl-9-oxo-1-azacycloundec-4-ene-2,7-dicarboxylate Traditional Name: (4E)-1-benzyl-9-keto-1-azacycloundec-4-ene-2,7-dicarboxylic acid dimethyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CCC(N(CCC(=O)C1)CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1C/C=C/CC(N(CCC(=O)C1)CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H27NO5/c1-26-20(24)17-10-6-7-11-19(21(25)27-2)22(13-12-18(23)14-17)15-16-8-4-3-5-9-16/h3-9,17,19H,10-15H2,1-2H3/b7-6+