(2R)-1-(2,5-dimethylphenoxy)-3-(6-nitroindazol-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(2,5-dimethylphenoxy)-3-(6-nitroindazol-1-yl)propan-2-ol Openeye Name: (2R)-1-(2,5-dimethylphenoxy)-3-(6-nitroindazol-1-yl)propan-2-ol CAS Name: (2R)-1-(2,5-dimethylphenoxy)-3-(6-nitro-1-indazolyl)-2-propanol IUPAC Name: (2R)-1-(2,5-dimethylphenoxy)-3-(6-nitroindazol-1-yl)propan-2-ol Traditional Name: (2R)-1-(2,5-dimethylphenoxy)-3-(6-nitroindazol-1-yl)propan-2-ol Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC[C@@H](CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)O

InChI

InChI=1S/C18H19N3O4/c1-12-3-4-13(2)18(7-12)25-11-16(22)10-20-17-8-15(21(23)24)6-5-14(17)9-19-20/h3-9,16,22H,10-11H2,1-2H3/t16-/m1/s1