dimethyl 5-[2-(cyclooctylamino)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(cyclooctylamino)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(cyclooctylamino)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(cyclooctylamino)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(cyclooctylamino)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(cyclooctylamino)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CNC2CCCCCCC2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CNC2CCCCCCC2)C(=O)OC

InChI

InChI=1S/C20H28N2O5/c1-26-19(24)14-10-15(20(25)27-2)12-17(11-14)22-18(23)13-21-16-8-6-4-3-5-7-9-16/h10-12,16,21H,3-9,13H2,1-2H3,(H,22,23)