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

Systemtic Name: 1-[3-(4-chloranylphenoxy)pyrrolidin-1-yl]-3-(5-methyl-2-nitro-phenoxy)propan-2-ol Openeye Name: 1-[3-(4-chlorophenoxy)pyrrolidin-1-yl]-3-(5-methyl-2-nitro-phenoxy)propan-2-ol CAS Name: 1-[3-(4-chlorophenoxy)-1-pyrrolidinyl]-3-(5-methyl-2-nitrophenoxy)-2-propanol IUPAC Name: 1-[3-(4-chlorophenoxy)pyrrolidin-1-yl]-3-(5-methyl-2-nitrophenoxy)propan-2-ol Traditional Name: 1-[3-(4-chlorophenoxy)pyrrolidino]-3-(5-methyl-2-nitro-phenoxy)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-])OCC(CN2CCC(C2)OC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(CN2CCC(C2)OC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H23ClN2O5/c1-14-2-7-19(23(25)26)20(10-14)27-13-16(24)11-22-9-8-18(12-22)28-17-5-3-15(21)4-6-17/h2-7,10,16,18,24H,8-9,11-13H2,1H3