1-[2-[(3,5-dimethylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole

Systemtic Name: 1-[2-[(3,5-dimethylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole Openeye Name: 1-[2-[(3,5-dimethylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole CAS Name: 1-[2-[(3,5-dimethylphenyl)-phenylmethoxy]ethyl]-2-methyl-5-nitroimidazole IUPAC Name: 1-[2-[(3,5-dimethylphenyl)-phenylmethoxy]ethyl]-2-methyl-5-nitroimidazole Traditional Name: 1-[2-[(3,5-dimethylphenyl)-phenyl-methoxy]ethyl]-2-methyl-5-nitro-imidazole Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=CC=CC=C2)OCCN3C(=NC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=CC=CC=C2)OCCN3C(=NC=C3[N+](=O)[O-])C)C

InChI

InChI=1S/C21H23N3O3/c1-15-11-16(2)13-19(12-15)21(18-7-5-4-6-8-18)27-10-9-23-17(3)22-14-20(23)24(25)26/h4-8,11-14,21H,9-10H2,1-3H3