1-(4-chloranylphenoxy)-1-(5-methyl-2-nitro-phenoxy)-3-pyrrolidin-1-yl-propan-2-ol

Systemtic Name: 1-(4-chloranylphenoxy)-1-(5-methyl-2-nitro-phenoxy)-3-pyrrolidin-1-yl-propan-2-ol Openeye Name: 1-(4-chlorophenoxy)-1-(5-methyl-2-nitro-phenoxy)-3-pyrrolidin-1-yl-propan-2-ol CAS Name: 1-(4-chlorophenoxy)-1-(5-methyl-2-nitrophenoxy)-3-(1-pyrrolidinyl)-2-propanol IUPAC Name: 1-(4-chlorophenoxy)-1-(5-methyl-2-nitrophenoxy)-3-pyrrolidin-1-ylpropan-2-ol Traditional Name: 1-(4-chlorophenoxy)-1-(5-methyl-2-nitro-phenoxy)-3-pyrrolidino-propan-2-ol Formula: C20H23ClN2O5 MolecularWeight: 406.86002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(C(CN2CCCC2)O)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(C(CN2CCCC2)O)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O5/c1-14-4-9-17(23(25)26)19(12-14)28-20(18(24)13-22-10-2-3-11-22)27-16-7-5-15(21)6-8-16/h4-9,12,18,20,24H,2-3,10-11,13H2,1H3