1-[2-(3-nitrophenyl)imidazol-1-yl]-3-(2,3,6-trimethylphenoxy)propan-2-ol

Systemtic Name: 1-[2-(3-nitrophenyl)imidazol-1-yl]-3-(2,3,6-trimethylphenoxy)propan-2-ol Openeye Name: 1-[2-(3-nitrophenyl)imidazol-1-yl]-3-(2,3,6-trimethylphenoxy)propan-2-ol CAS Name: 1-[2-(3-nitrophenyl)-1-imidazolyl]-3-(2,3,6-trimethylphenoxy)-2-propanol IUPAC Name: 1-[2-(3-nitrophenyl)imidazol-1-yl]-3-(2,3,6-trimethylphenoxy)propan-2-ol Traditional Name: 1-[2-(3-nitrophenyl)imidazol-1-yl]-3-(2,3,6-trimethylphenoxy)propan-2-ol Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(CN2C=CN=C2C3=CC(=CC=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(CN2C=CN=C2C3=CC(=CC=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C21H23N3O4/c1-14-7-8-15(2)20(16(14)3)28-13-19(25)12-23-10-9-22-21(23)17-5-4-6-18(11-17)24(26)27/h4-11,19,25H,12-13H2,1-3H3