1-[2-[(4-tert-butylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole

Systemtic Name: 1-[2-[(4-tert-butylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole Openeye Name: 1-[2-[(4-tert-butylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole CAS Name: 1-[2-[(4-tert-butylphenyl)-phenylmethoxy]ethyl]-2-methyl-5-nitroimidazole IUPAC Name: 1-[2-[(4-tert-butylphenyl)-phenylmethoxy]ethyl]-2-methyl-5-nitroimidazole Traditional Name: 1-[2-[(4-tert-butylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O3/c1-17-24-16-21(26(27)28)25(17)14-15-29-22(18-8-6-5-7-9-18)19-10-12-20(13-11-19)23(2,3)4/h5-13,16,22H,14-15H2,1-4H3