4-[[3-(4-nitrophenoxy)-2-oxidanyl-propyl]-(phenylmethyl)amino]butan-1-ol

Systemtic Name: 4-[[3-(4-nitrophenoxy)-2-oxidanyl-propyl]-(phenylmethyl)amino]butan-1-ol Openeye Name: 4-[benzyl-[2-hydroxy-3-(4-nitrophenoxy)propyl]amino]butan-1-ol CAS Name: 4-[[2-hydroxy-3-(4-nitrophenoxy)propyl]-(phenylmethyl)amino]-1-butanol IUPAC Name: 4-[benzyl-[2-hydroxy-3-(4-nitrophenoxy)propyl]amino]butan-1-ol Traditional Name: 4-[benzyl-[2-hydroxy-3-(4-nitrophenoxy)propyl]amino]butan-1-ol Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCO)CC(COC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCO)CC(COC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C20H26N2O5/c23-13-5-4-12-21(14-17-6-2-1-3-7-17)15-19(24)16-27-20-10-8-18(9-11-20)22(25)26/h1-3,6-11,19,23-24H,4-5,12-16H2