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

Systemtic Name: propan-2-yl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride Openeye Name: isopropyl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride CAS Name: 2-[[2,3-bis(diethylamino)-1-oxopropyl]amino]benzoic acid propan-2-yl ester dihydrochloride IUPAC Name: propan-2-yl 2-[2,3-bis(diethylamino)propanoylamino]benzoate dihydrochloride Traditional Name: 2-[2,3-bis(diethylamino)propanoylamino]benzoic acid isopropyl ester dihydrochloride Formula: C21H37Cl2N3O3 MolecularWeight: 450.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C(=O)NC1=CC=CC=C1C(=O)OC(C)C)N(CC)CC.Cl.Cl

Isomeric SMILES

CCN(CC)CC(C(=O)NC1=CC=CC=C1C(=O)OC(C)C)N(CC)CC.Cl.Cl

InChI

InChI=1S/C21H35N3O3.2ClH/c1-7-23(8-2)15-19(24(9-3)10-4)20(25)22-18-14-12-11-13-17(18)21(26)27-16(5)6;;/h11-14,16,19H,7-10,15H2,1-6H3,(H,22,25);2*1H