4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-[(4-nitrophenyl)methylamino]phenol hydrochloride

Systemtic Name: 4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-[(4-nitrophenyl)methylamino]phenol hydrochloride Openeye Name: 4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-[(4-nitrophenyl)methylamino]phenol hydrochloride CAS Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-[(4-nitrophenyl)methylamino]phenol hydrochloride IUPAC Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-[(4-nitrophenyl)methylamino]phenol hydrochloride Traditional Name: 4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-[(4-nitrobenzyl)amino]phenol hydrochloride Formula: C19H26ClN3O4 MolecularWeight: 395.88044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(C1=CC(=C(C=C1)O)NCC2=CC=C(C=C2)[N+](=O)[O-])O.Cl

Isomeric SMILES

CC(C)(C)NCC(C1=CC(=C(C=C1)O)NCC2=CC=C(C=C2)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C19H25N3O4.ClH/c1-19(2,3)21-12-18(24)14-6-9-17(23)16(10-14)20-11-13-4-7-15(8-5-13)22(25)26;/h4-10,18,20-21,23-24H,11-12H2,1-3H3;1H