N-[5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]-4-nitro-benzamide hydrochloride

Systemtic Name: N-[5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]-4-nitro-benzamide hydrochloride Openeye Name: N-[5-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-hydroxy-phenyl]-4-nitro-benzamide hydrochloride CAS Name: N-[5-[2-(tert-butylamino)-1-hydroxyethyl]-2-hydroxyphenyl]-4-nitrobenzamide hydrochloride IUPAC Name: N-[5-[2-(tert-butylamino)-1-hydroxyethyl]-2-hydroxyphenyl]-4-nitrobenzamide hydrochloride Traditional Name: N-[5-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-hydroxy-phenyl]-4-nitro-benzamide hydrochloride Formula: C19H24ClN3O5 MolecularWeight: 409.86396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O5.ClH/c1-19(2,3)20-11-17(24)13-6-9-16(23)15(10-13)21-18(25)12-4-7-14(8-5-12)22(26)27;/h4-10,17,20,23-24H,11H2,1-3H3,(H,21,25);1H