ethanoic acid; 1-(2-fluorophenyl)-2-[4-(4-nitrophenyl)butan-2-ylamino]ethanol

Systemtic Name: ethanoic acid; 1-(2-fluorophenyl)-2-[4-(4-nitrophenyl)butan-2-ylamino]ethanol Openeye Name: acetic acid; 1-(2-fluorophenyl)-2-[[1-methyl-3-(4-nitrophenyl)propyl]amino]ethanol CAS Name: acetic acid; 1-(2-fluorophenyl)-2-[4-(4-nitrophenyl)butan-2-ylamino]ethanol IUPAC Name: acetic acid; 1-(2-fluorophenyl)-2-[4-(4-nitrophenyl)butan-2-ylamino]ethanol Traditional Name: acetic acid; 1-(2-fluorophenyl)-2-[[1-methyl-3-(4-nitrophenyl)propyl]amino]ethanol Formula: C20H25FN2O5 MolecularWeight: 392.421303

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)[N+](=O)[O-])NCC(C2=CC=CC=C2F)O.CC(=O)O

Isomeric SMILES

CC(CCC1=CC=C(C=C1)[N+](=O)[O-])NCC(C2=CC=CC=C2F)O.CC(=O)O

InChI

InChI=1S/C18H21FN2O3.C2H4O2/c1-13(6-7-14-8-10-15(11-9-14)21(23)24)20-12-18(22)16-4-2-3-5-17(16)19;1-2(3)4/h2-5,8-11,13,18,20,22H,6-7,12H2,1H3;1H3,(H,3,4)