butyl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride

Systemtic Name: butyl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride Openeye Name: butyl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride CAS Name: 2-[[2,3-bis(diethylamino)-1-oxopropyl]amino]benzoic acid butyl ester dihydrochloride IUPAC Name: butyl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride Traditional Name: 2-[2,3-bis(diethylamino)propanoylamino]benzoic acid butyl ester dihydrochloride Formula: C22H39Cl2N3O3 MolecularWeight: 464.46936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)C(CN(CC)CC)N(CC)CC.Cl.Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)C(CN(CC)CC)N(CC)CC.Cl.Cl

InChI

InChI=1S/C22H37N3O3.2ClH/c1-6-11-16-28-22(27)18-14-12-13-15-19(18)23-21(26)20(25(9-4)10-5)17-24(7-2)8-3;;/h12-15,20H,6-11,16-17H2,1-5H3,(H,23,26);2*1H