O2-[3-(dibutylamino)propyl] O1-propan-2-yl 3-azanylbenzene-1,2-dicarboxylate

Systemtic Name: O2-[3-(dibutylamino)propyl] O1-propan-2-yl 3-azanylbenzene-1,2-dicarboxylate Openeye Name: O2-[3-(dibutylamino)propyl] O1-isopropyl 3-aminobenzene-1,2-dicarboxylate CAS Name: 3-aminobenzene-1,2-dicarboxylic acid O2-[3-(dibutylamino)propyl] ester O1-propan-2-yl ester IUPAC Name: 2-O-[3-(dibutylamino)propyl] 1-O-propan-2-yl 3-aminobenzene-1,2-dicarboxylate Traditional Name: 3-aminobenzene-1,2-dicarboxylic acid O2-[3-(dibutylamino)propyl] ester O1-isopropyl ester Formula: C22H36N2O4 MolecularWeight: 392.53224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC(=O)C1=C(C=CC=C1N)C(=O)OC(C)C

Isomeric SMILES

CCCCN(CCCC)CCCOC(=O)C1=C(C=CC=C1N)C(=O)OC(C)C

InChI

InChI=1S/C22H36N2O4/c1-5-7-13-24(14-8-6-2)15-10-16-27-22(26)20-18(11-9-12-19(20)23)21(25)28-17(3)4/h9,11-12,17H,5-8,10,13-16,23H2,1-4H3