bis(dimethylamino) 5-[2-(tert-butylamino)-1-oxidanyl-ethyl]benzene-1,3-dicarboxylate hydrochloride

Systemtic Name: bis(dimethylamino) 5-[2-(tert-butylamino)-1-oxidanyl-ethyl]benzene-1,3-dicarboxylate hydrochloride Openeye Name: bis(dimethylamino) 5-[2-(tert-butylamino)-1-hydroxy-ethyl]benzene-1,3-dicarboxylate hydrochloride CAS Name: 5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-dicarboxylic acid bis(dimethylamino) ester hydrochloride IUPAC Name: bis(dimethylamino) 5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-dicarboxylate hydrochloride Traditional Name: 5-[2-(tert-butylamino)-1-hydroxy-ethyl]benzene-1,3-dicarboxylic acid bis(dimethylamino) ester hydrochloride Formula: C18H30ClN3O5 MolecularWeight: 403.9009

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(C1=CC(=CC(=C1)C(=O)ON(C)C)C(=O)ON(C)C)O.Cl

Isomeric SMILES

CC(C)(C)NCC(C1=CC(=CC(=C1)C(=O)ON(C)C)C(=O)ON(C)C)O.Cl

InChI

InChI=1S/C18H29N3O5.ClH/c1-18(2,3)19-11-15(22)12-8-13(16(23)25-20(4)5)10-14(9-12)17(24)26-21(6)7;/h8-10,15,19,22H,11H2,1-7H3;1H