1-[3-(4-nitrophenoxy)propyl]-4-(phenylmethyl)piperidine-2,4-diol hydrochloride

Systemtic Name: 1-[3-(4-nitrophenoxy)propyl]-4-(phenylmethyl)piperidine-2,4-diol hydrochloride Openeye Name: 4-benzyl-1-[3-(4-nitrophenoxy)propyl]piperidine-2,4-diol hydrochloride CAS Name: 1-[3-(4-nitrophenoxy)propyl]-4-(phenylmethyl)piperidine-2,4-diol hydrochloride IUPAC Name: 4-benzyl-1-[3-(4-nitrophenoxy)propyl]piperidine-2,4-diol hydrochloride Traditional Name: 4-benzyl-1-[3-(4-nitrophenoxy)propyl]piperidine-2,4-diol hydrochloride Formula: C21H27ClN2O5 MolecularWeight: 422.90248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1(CC2=CC=CC=C2)O)O)CCCOC3=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

C1CN(C(CC1(CC2=CC=CC=C2)O)O)CCCOC3=CC=C(C=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C21H26N2O5.ClH/c24-20-16-21(25,15-17-5-2-1-3-6-17)11-13-22(20)12-4-14-28-19-9-7-18(8-10-19)23(26)27;/h1-3,5-10,20,24-25H,4,11-16H2;1H