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

Systemtic Name: dimethyl 5-[2-(azocan-1-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(azocan-1-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(1-azocanyl)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(azocan-1-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(azocan-1-yl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2CCCCCCC2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2CCCCCCC2)C(=O)OC

InChI

InChI=1S/C19H26N2O5/c1-25-18(23)14-10-15(19(24)26-2)12-16(11-14)20-17(22)13-21-8-6-4-3-5-7-9-21/h10-12H,3-9,13H2,1-2H3,(H,20,22)