dimethyl 5-[5-[(cycloheptylamino)methyl]furan-2-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[5-[(cycloheptylamino)methyl]furan-2-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[5-[(cycloheptylamino)methyl]-2-furyl]benzene-1,3-dicarboxylate CAS Name: 5-[5-[(cycloheptylamino)methyl]-2-furanyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[5-[(cycloheptylamino)methyl]furan-2-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[5-[(cycloheptylamino)methyl]-2-furyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C2=CC=C(O2)CNC3CCCCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C2=CC=C(O2)CNC3CCCCCC3)C(=O)OC

InChI

InChI=1S/C22H27NO5/c1-26-21(24)16-11-15(12-17(13-16)22(25)27-2)20-10-9-19(28-20)14-23-18-7-5-3-4-6-8-18/h9-13,18,23H,3-8,14H2,1-2H3